Organoheterocyclic compounds

Organic compounds that consist of ring structures, or cyclic compounds that have atoms of at least two different elements as members of its ring(s).

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2,191 – 2,205 of 195,586 results

2,191

2-Bromo-1,3-thiazole-4-carboxylic acid, 98%

CAS: 5198-88-9 Molecular Formula: C₄H₂BrNO₂S Molecular Weight (g/mol): 208.03 InChI Key: BEGREHRAUWCAHV-UHFFFAOYSA-N Synonym: 2-bromo-4-thiazolecarboxylic acid,2-bromothiazole-4-carboxylic acid,2-bromo-thiazole-4-carboxylic acid,4-thiazolecarboxylic acid, 2-bromo,2-bromo-4-thiazolecarboxylicacid,2-bromothiazole-4-carboxylicacid,2-bromo-4-carboxy-1,3-thiazole,pubchem22900,acmc-1avkr,2-bromo-4-carboxythiazole PubChem CID: 2763209 IUPAC Name: 2-bromo-1,3-thiazole-4-carboxylic acid SMILES: C1=C(N=C(S1)Br)C(=O)O

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Specifications

PubChem CID	2763209
CAS	5198-88-9
Molecular Weight (g/mol)	208.03
SMILES	C1=C(N=C(S1)Br)C(=O)O
Synonym	2-bromo-4-thiazolecarboxylic acid,2-bromothiazole-4-carboxylic acid,2-bromo-thiazole-4-carboxylic acid,4-thiazolecarboxylic acid, 2-bromo,2-bromo-4-thiazolecarboxylicacid,2-bromothiazole-4-carboxylicacid,2-bromo-4-carboxy-1,3-thiazole,pubchem22900,acmc-1avkr,2-bromo-4-carboxythiazole
IUPAC Name	2-bromo-1,3-thiazole-4-carboxylic acid
InChI Key	BEGREHRAUWCAHV-UHFFFAOYSA-N
Molecular Formula	C₄H₂BrNO₂S

2,192

2-Bromo-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-1-ethanone, 95%, Thermo Scientific™

CAS: 7520-95-8 Molecular Formula: C12H10BrNOS Molecular Weight (g/mol): 296.182 MDL Number: MFCD04071443 InChI Key: BOMSILGSXFNLJX-UHFFFAOYSA-N Synonym: 2-bromo-1-4-methyl-2-phenyl-1,3-thiazol-5-yl-1-ethanone,2-bromo-1-4-methyl-2-phenyl-1,3-thiazol-5-yl ethanone,5-bromoacetyl-4-methyl-2-phenylthiazole,2-bromo-1-4-methyl-2-phenylthiazol-5-yl ethanone,2-bromo-1-4-methyl-2-phenyl 1,3-thiazol-5-yl ethan-1-one PubChem CID: 2795492 IUPAC Name: 2-bromo-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)ethanone SMILES: CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)CBr

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Specifications

PubChem CID	2795492
CAS	7520-95-8
Molecular Weight (g/mol)	296.182
MDL Number	MFCD04071443
SMILES	CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)CBr
Synonym	2-bromo-1-4-methyl-2-phenyl-1,3-thiazol-5-yl-1-ethanone,2-bromo-1-4-methyl-2-phenyl-1,3-thiazol-5-yl ethanone,5-bromoacetyl-4-methyl-2-phenylthiazole,2-bromo-1-4-methyl-2-phenylthiazol-5-yl ethanone,2-bromo-1-4-methyl-2-phenyl 1,3-thiazol-5-yl ethan-1-one
IUPAC Name	2-bromo-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)ethanone
InChI Key	BOMSILGSXFNLJX-UHFFFAOYSA-N
Molecular Formula	C12H10BrNOS

2,193

Ethyl 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate, 97%, Thermo Scientific™

CAS: 32043-95-1 Molecular Formula: C13H13NO2S Molecular Weight (g/mol): 247.31 MDL Number: MFCD07346320 InChI Key: UHLMXNFHHFDVPW-UHFFFAOYSA-N Synonym: ethyl 2-methyl-4-phenylthiazole-5-carboxylate,2-methyl-4-phenylthiazole-5-carboxylic acid ethyl ester,2-methyl-4-phenyl-thiazole-5-carboxylic acid ethyl ester,5-thiazolecarboxylicacid, 2-methyl-4-phenyl-, ethyl ester PubChem CID: 7131013 IUPAC Name: ethyl 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate SMILES: CCOC(=O)C1=C(N=C(C)S1)C1=CC=CC=C1

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Specifications

PubChem CID	7131013
CAS	32043-95-1
Molecular Weight (g/mol)	247.31
MDL Number	MFCD07346320
SMILES	CCOC(=O)C1=C(N=C(C)S1)C1=CC=CC=C1
Synonym	ethyl 2-methyl-4-phenylthiazole-5-carboxylate,2-methyl-4-phenylthiazole-5-carboxylic acid ethyl ester,2-methyl-4-phenyl-thiazole-5-carboxylic acid ethyl ester,5-thiazolecarboxylicacid, 2-methyl-4-phenyl-, ethyl ester
IUPAC Name	ethyl 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate
InChI Key	UHLMXNFHHFDVPW-UHFFFAOYSA-N
Molecular Formula	C13H13NO2S

2,194

tert-Butyl 4-(3-hydroxypropyl)tetrahydro-1(2H)-pyridinecarboxylate, 97%, Thermo Scientific™

CAS: 156185-63-6 Molecular Formula: C13H25NO3 Molecular Weight (g/mol): 243.347 InChI Key: OXPWHPCCUXESFQ-UHFFFAOYSA-N Synonym: tert-butyl 4-3-hydroxypropyl piperidine-1-carboxylate,tert-butyl 4-3-hydroxypropyl tetrahydro-1 2h-pyridinecarboxylate,3-1-boc-4-piperidyl-1-propanol,1-n-boc-4-3'-propanol-piperdine,3-n-boc-piperidin-4-yl propanol,boc-4-piperidinepropanol,4-3-hydroxypropyl piperidine, n-boc protected,1-n-boc-4-3'-propanol-piperidine,4-3-hydroxy-propyl-piperidine-1-carboxylic acid tert-butyl ester,tert-butyl 4-3-hydroxypropyl piperidinecarboxylate PubChem CID: 2800739 IUPAC Name: tert-butyl 4-(3-hydroxypropyl)piperidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCC(CC1)CCCO

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Specifications

PubChem CID	2800739
CAS	156185-63-6
Molecular Weight (g/mol)	243.347
SMILES	CC(C)(C)OC(=O)N1CCC(CC1)CCCO
Synonym	tert-butyl 4-3-hydroxypropyl piperidine-1-carboxylate,tert-butyl 4-3-hydroxypropyl tetrahydro-1 2h-pyridinecarboxylate,3-1-boc-4-piperidyl-1-propanol,1-n-boc-4-3'-propanol-piperdine,3-n-boc-piperidin-4-yl propanol,boc-4-piperidinepropanol,4-3-hydroxypropyl piperidine, n-boc protected,1-n-boc-4-3'-propanol-piperidine,4-3-hydroxy-propyl-piperidine-1-carboxylic acid tert-butyl ester,tert-butyl 4-3-hydroxypropyl piperidinecarboxylate
IUPAC Name	tert-butyl 4-(3-hydroxypropyl)piperidine-1-carboxylate
InChI Key	OXPWHPCCUXESFQ-UHFFFAOYSA-N
Molecular Formula	C13H25NO3

2,195

1-(pyrid-3-ylmethyl)piperidine-4-carboxylic acid dihydrochloride, 97%, Thermo Scientific™

CAS: 946409-40-1 Molecular Formula: C12H18Cl2N2O2 Molecular Weight (g/mol): 293.188 MDL Number: MFCD06801260 InChI Key: FLINLLCJYJQIIY-UHFFFAOYSA-N Synonym: 1-pyridin-3-ylmethyl piperidine-4-carboxylic acid dihydrochloride,1-pyrid-3-ylmethyl piperidine-4-carboxylic acid dihydrochloride,1-pyridin-3-yl methyl piperidine-4-carboxylic acid dihydrochloride,1-pyridin-3-yl methyl piperidine-4-carboxylic acid-hydrogen chloride 1/2 PubChem CID: 42935493 IUPAC Name: 1-(pyridin-3-ylmethyl)piperidine-4-carboxylic acid;dihydrochloride SMILES: C1CN(CCC1C(=O)O)CC2=CN=CC=C2.Cl.Cl

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Specifications

PubChem CID	42935493
CAS	946409-40-1
Molecular Weight (g/mol)	293.188
MDL Number	MFCD06801260
SMILES	C1CN(CCC1C(=O)O)CC2=CN=CC=C2.Cl.Cl
Synonym	1-pyridin-3-ylmethyl piperidine-4-carboxylic acid dihydrochloride,1-pyrid-3-ylmethyl piperidine-4-carboxylic acid dihydrochloride,1-pyridin-3-yl methyl piperidine-4-carboxylic acid dihydrochloride,1-pyridin-3-yl methyl piperidine-4-carboxylic acid-hydrogen chloride 1/2
IUPAC Name	1-(pyridin-3-ylmethyl)piperidine-4-carboxylic acid;dihydrochloride
InChI Key	FLINLLCJYJQIIY-UHFFFAOYSA-N
Molecular Formula	C12H18Cl2N2O2

2,196

Trimethylene sulfide

CAS: 287-27-4 Molecular Formula: C3H6S Molecular Weight (g/mol): 74.14 MDL Number: MFCD00042751 InChI Key: XSROQCDVUIHRSI-UHFFFAOYSA-N IUPAC Name: thietane SMILES: C1CSC1

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Specifications

CAS	287-27-4
Molecular Weight (g/mol)	74.14
MDL Number	MFCD00042751
SMILES	C1CSC1
IUPAC Name	thietane
InChI Key	XSROQCDVUIHRSI-UHFFFAOYSA-N
Molecular Formula	C3H6S

2,197

Thermo Scientific Chemicals Isonipecotic Acid, 99%

CAS: 498-94-2 Molecular Formula: C6H11NO2 Molecular Weight (g/mol): 129.16 MDL Number: MFCD00006004 InChI Key: SRJOCJYGOFTFLH-UHFFFAOYSA-N Synonym: isonipecotic acid,4-piperidinecarboxylic acid,4-carboxypiperidine,hexahydroisonicotinic acid,dl-isopipecolinic acid,isonicotinic acid, hexahydro,h-inp-oh,acide isonipecotique,4-hexahydroisonicotinic acid,unii-m5tzp1rwie PubChem CID: 3773 IUPAC Name: piperidine-4-carboxylic acid SMILES: OC(=O)C1CCNCC1

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PubChem CID	3773
CAS	498-94-2
Molecular Weight (g/mol)	129.16
MDL Number	MFCD00006004
SMILES	OC(=O)C1CCNCC1
Synonym	isonipecotic acid,4-piperidinecarboxylic acid,4-carboxypiperidine,hexahydroisonicotinic acid,dl-isopipecolinic acid,isonicotinic acid, hexahydro,h-inp-oh,acide isonipecotique,4-hexahydroisonicotinic acid,unii-m5tzp1rwie
IUPAC Name	piperidine-4-carboxylic acid
InChI Key	SRJOCJYGOFTFLH-UHFFFAOYSA-N
Molecular Formula	C6H11NO2

2,198

N-Benzyl-4-(2-hydroxyethyl)piperidine, 97%, Thermo Scientific™

CAS: 76876-70-5 Molecular Formula: C₁₄H₂₁NO Molecular Weight (g/mol): 219.33 MDL Number: MFCD00800492 InChI Key: FBFPTWSKNJHCGT-UHFFFAOYSA-N Synonym: 2-1-benzylpiperidin-4-yl ethanol,n-benzyl-4-2-hydroxyethyl piperidine,1-benzyl-4-2-hydroxyethyl piperdine,1-benzyl-4-2-hydroxyethyl piperidine,2-1-benzyl-4-piperidyl ethan-1-ol,1-benzylpiperidine-4-ethanol,1-phenylmethyl-4-piperidineethanol,4-piperidineethanol,1-phenylmethyl,2-1-benzylpiperidin-4-yl ethan-1-ol,n-benzyl-4-2-hydroxyethyl-piperidine PubChem CID: 2725029 IUPAC Name: 2-(1-benzylpiperidin-4-yl)ethanol SMILES: C1CN(CCC1CCO)CC2=CC=CC=C2

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Specifications

PubChem CID	2725029
CAS	76876-70-5
Molecular Weight (g/mol)	219.33
MDL Number	MFCD00800492
SMILES	C1CN(CCC1CCO)CC2=CC=CC=C2
Synonym	2-1-benzylpiperidin-4-yl ethanol,n-benzyl-4-2-hydroxyethyl piperidine,1-benzyl-4-2-hydroxyethyl piperdine,1-benzyl-4-2-hydroxyethyl piperidine,2-1-benzyl-4-piperidyl ethan-1-ol,1-benzylpiperidine-4-ethanol,1-phenylmethyl-4-piperidineethanol,4-piperidineethanol,1-phenylmethyl,2-1-benzylpiperidin-4-yl ethan-1-ol,n-benzyl-4-2-hydroxyethyl-piperidine
IUPAC Name	2-(1-benzylpiperidin-4-yl)ethanol
InChI Key	FBFPTWSKNJHCGT-UHFFFAOYSA-N
Molecular Formula	C₁₄H₂₁NO

2,199

1-BOC-Piperidine, 97%

CAS: 75844-69-8 Molecular Formula: C₁₀H₁₉NO₂ Molecular Weight (g/mol): 185.27 InChI Key: RQCNHUCCQJMSRG-UHFFFAOYSA-N Synonym: 1-boc-piperidine,n-boc-piperidine,1-tert-butoxycarbonyl piperidine,1-piperidinecarboxylic acid, 1,1-dimethylethyl ester,piperidine-1-carboxylic acid tert-butyl ester,tert-butyl piperidinecarboxylate,boc-piperidine,n-boc piperidine,pubchem7258,n-boc tetrahydropyridine PubChem CID: 7010304 IUPAC Name: tert-butyl piperidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCCCC1

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Specifications

PubChem CID	7010304
CAS	75844-69-8
Molecular Weight (g/mol)	185.27
SMILES	CC(C)(C)OC(=O)N1CCCCC1
Synonym	1-boc-piperidine,n-boc-piperidine,1-tert-butoxycarbonyl piperidine,1-piperidinecarboxylic acid, 1,1-dimethylethyl ester,piperidine-1-carboxylic acid tert-butyl ester,tert-butyl piperidinecarboxylate,boc-piperidine,n-boc piperidine,pubchem7258,n-boc tetrahydropyridine
IUPAC Name	tert-butyl piperidine-1-carboxylate
InChI Key	RQCNHUCCQJMSRG-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₉NO₂

2,200

(1S,2R,6S,7R)-4,4-Dimethyl-3,5-dioxa-8-azatricyclo[5.2.1.0(2,6)]decan-9-one, 95%, 98% ee

CAS: 178032-63-8 Molecular Formula: C₉H₁₃NO₃ Molecular Weight (g/mol): 183.2 MDL Number: MFCD01320865 InChI Key: CSGIROCFQXHTKS-WNJXEPBRSA-N Synonym: 1s,2r,6s,7r-4,4-dimethyl-3,5-dioxa-8-azatricyclo 5.2.1.0 2,6 decan-9-one,3as,4r,7s,7ar-2,2-dimethyltetrahydro-4,7-methano 1,3 dioxolo 4,5-c pyridin-6 3ah-one,2s,7s,1r,6r-4,4-dimethyl-3,5-dioxa-9-azatricyclo 5.2.1.0<2,6> decan-8-one,1s,2r,6s,7r-4,4-dimethyl-3,5-dioxa-8-azatricyclo 5.2.1.0 2 ,? decan-9-one,4,7-methano-1,3-dioxolo 4,5-c pyridin-6 3ah-one,tetrahydro-2,2-dimethyl-, 3as,4r,7s,7ar PubChem CID: 10219706 SMILES: CC1(OC2C3CC(C2O1)NC3=O)C

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PubChem CID	10219706
CAS	178032-63-8
Molecular Weight (g/mol)	183.2
MDL Number	MFCD01320865
SMILES	CC1(OC2C3CC(C2O1)NC3=O)C
Synonym	1s,2r,6s,7r-4,4-dimethyl-3,5-dioxa-8-azatricyclo 5.2.1.0 2,6 decan-9-one,3as,4r,7s,7ar-2,2-dimethyltetrahydro-4,7-methano 1,3 dioxolo 4,5-c pyridin-6 3ah-one,2s,7s,1r,6r-4,4-dimethyl-3,5-dioxa-9-azatricyclo 5.2.1.0<2,6> decan-8-one,1s,2r,6s,7r-4,4-dimethyl-3,5-dioxa-8-azatricyclo 5.2.1.0 2 ,? decan-9-one,4,7-methano-1,3-dioxolo 4,5-c pyridin-6 3ah-one,tetrahydro-2,2-dimethyl-, 3as,4r,7s,7ar
InChI Key	CSGIROCFQXHTKS-WNJXEPBRSA-N
Molecular Formula	C₉H₁₃NO₃

2,201

Ethyl 1-Boc-DL-nipecotate, 97%, Thermo Scientific Chemicals

CAS: 130250-54-3 Molecular Formula: C13H23NO4 Molecular Weight (g/mol): 257.33 MDL Number: MFCD04116274 InChI Key: YCXCRFGBFZTUSU-UHFFFAOYSA-N Synonym: ethyl 1-boc-3-piperidinecarboxylate,1-tert-butyl 3-ethyl piperidine-1,3-dicarboxylate,ethyl n-boc-piperidine-3-carboxylate,ethyl n-boc-3-piperidinecarboxylate,ethyl1-boc-3-piperidinecarboxylate,1-boc-piperidine-3-carboxylic acid ethyl ester,ethyl-n-boc-piperidine-3-carboxylate,1-tert-butyl 3-ethyl tetrahydro-1,3 2h-pyridinedicarboxylate,1,3-piperidinedicarboxylic acid, 1-1,1-dimethylethyl 3-ethyl ester,piperidine-1,3-dicarboxylic acid 1-tert-butyl 3-ethyl ester PubChem CID: 357727 IUPAC Name: 1-O-tert-butyl 3-O-ethyl piperidine-1,3-dicarboxylate SMILES: CCOC(=O)C1CCCN(C1)C(=O)OC(C)(C)C

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Specifications

PubChem CID	357727
CAS	130250-54-3
Molecular Weight (g/mol)	257.33
MDL Number	MFCD04116274
SMILES	CCOC(=O)C1CCCN(C1)C(=O)OC(C)(C)C
Synonym	ethyl 1-boc-3-piperidinecarboxylate,1-tert-butyl 3-ethyl piperidine-1,3-dicarboxylate,ethyl n-boc-piperidine-3-carboxylate,ethyl n-boc-3-piperidinecarboxylate,ethyl1-boc-3-piperidinecarboxylate,1-boc-piperidine-3-carboxylic acid ethyl ester,ethyl-n-boc-piperidine-3-carboxylate,1-tert-butyl 3-ethyl tetrahydro-1,3 2h-pyridinedicarboxylate,1,3-piperidinedicarboxylic acid, 1-1,1-dimethylethyl 3-ethyl ester,piperidine-1,3-dicarboxylic acid 1-tert-butyl 3-ethyl ester
IUPAC Name	1-O-tert-butyl 3-O-ethyl piperidine-1,3-dicarboxylate
InChI Key	YCXCRFGBFZTUSU-UHFFFAOYSA-N
Molecular Formula	C13H23NO4

2,202

1-Methylpiperidine-4-carboxylic acid hydrochloride, 96%

CAS: 71985-80-3 Molecular Formula: C7H14ClNO2 Molecular Weight (g/mol): 179.644 MDL Number: MFCD00190235 InChI Key: NLUDEWJJEMHIIL-UHFFFAOYSA-N Synonym: 1-methylpiperidine-4-carboxylic acid hydrochloride,1-methyl-piperidine-4-carboxylic acid hydrochloride,1-methylpiperidine-4-carboxylic acid hcl,4-carboxy-1-methyl-piperidine hcl,1-methyl-4-piperidinecarboxylic acid hydrochloride,1-methyl-piperidine-4-carboxylic acid hcl,4-piperidinecarboxylic acid, 1-methyl-, hydrochloride,1-methylpiperidine-4-carboxylic acid, chloride,4-piperidinecarboxylicacid,1-methyl-,hydrochloride 1:1,pubchem8007 PubChem CID: 2760043 IUPAC Name: 1-methylpiperidine-4-carboxylic acid;hydrochloride SMILES: CN1CCC(CC1)C(=O)O.Cl

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Specifications

PubChem CID	2760043
CAS	71985-80-3
Molecular Weight (g/mol)	179.644
MDL Number	MFCD00190235
SMILES	CN1CCC(CC1)C(=O)O.Cl
Synonym	1-methylpiperidine-4-carboxylic acid hydrochloride,1-methyl-piperidine-4-carboxylic acid hydrochloride,1-methylpiperidine-4-carboxylic acid hcl,4-carboxy-1-methyl-piperidine hcl,1-methyl-4-piperidinecarboxylic acid hydrochloride,1-methyl-piperidine-4-carboxylic acid hcl,4-piperidinecarboxylic acid, 1-methyl-, hydrochloride,1-methylpiperidine-4-carboxylic acid, chloride,4-piperidinecarboxylicacid,1-methyl-,hydrochloride 1:1,pubchem8007
IUPAC Name	1-methylpiperidine-4-carboxylic acid;hydrochloride
InChI Key	NLUDEWJJEMHIIL-UHFFFAOYSA-N
Molecular Formula	C7H14ClNO2

2,203

Methyl piperidine-4-carboxylate, 98%

CAS: 2971-79-1 Molecular Formula: C7H13NO2 Molecular Weight (g/mol): 143.19 MDL Number: MFCD00190578 InChI Key: RZVWBASHHLFBJF-UHFFFAOYSA-N Synonym: methyl isonipecotate,methyl 4-piperidinecarboxylate,4-piperidinecarboxylic acid, methyl ester,piperidine-4-carboxylic acid methyl ester,4-piperidinecarboxylic acid methyl ester,isonipecotic acid methyl ester,methylpiperidine-4-carboxylate,methylisonipecotate,methyl piperidin-4-carboxylate,acmc-20aiv4 PubChem CID: 424914 IUPAC Name: methyl piperidine-4-carboxylate SMILES: COC(=O)C1CCNCC1

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Specifications

PubChem CID	424914
CAS	2971-79-1
Molecular Weight (g/mol)	143.19
MDL Number	MFCD00190578
SMILES	COC(=O)C1CCNCC1
Synonym	methyl isonipecotate,methyl 4-piperidinecarboxylate,4-piperidinecarboxylic acid, methyl ester,piperidine-4-carboxylic acid methyl ester,4-piperidinecarboxylic acid methyl ester,isonipecotic acid methyl ester,methylpiperidine-4-carboxylate,methylisonipecotate,methyl piperidin-4-carboxylate,acmc-20aiv4
IUPAC Name	methyl piperidine-4-carboxylate
InChI Key	RZVWBASHHLFBJF-UHFFFAOYSA-N
Molecular Formula	C7H13NO2

2,204

4-Hydroxy-4-phenylpiperidine, 99%

CAS: 40807-61-2 Molecular Formula: C11H15NO Molecular Weight (g/mol): 177.247 MDL Number: MFCD00006000 InChI Key: KQKFQBTWXOGINC-UHFFFAOYSA-N PubChem CID: 96387 IUPAC Name: 4-phenylpiperidin-4-ol SMILES: C1CNCCC1(C2=CC=CC=C2)O

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Specifications

PubChem CID	96387
CAS	40807-61-2
Molecular Weight (g/mol)	177.247
MDL Number	MFCD00006000
SMILES	C1CNCCC1(C2=CC=CC=C2)O
IUPAC Name	4-phenylpiperidin-4-ol
InChI Key	KQKFQBTWXOGINC-UHFFFAOYSA-N
Molecular Formula	C11H15NO

2,205

4-(Piperidin-1-ylmethyl)benzonitrile, ≥97%, Thermo Scientific™

CAS: 727733-92-8 Molecular Formula: C13H16N2 Molecular Weight (g/mol): 200.285 MDL Number: MFCD06796182 InChI Key: JOGVBKNLRQCYKS-UHFFFAOYSA-N Synonym: 4-piperidin-1-ylmethyl benzonitrile,1-4-cyanobenzyl piperidine,4-piperidinomethyl benzonitrile,4-piperidylmethyl benzenecarbonitrile,4-piperidin-1-ylmethyl-benzonitrile,benzonitrile,4-1-piperidinylmethyl PubChem CID: 7537603 IUPAC Name: 4-(piperidin-1-ylmethyl)benzonitrile SMILES: C1CCN(CC1)CC2=CC=C(C=C2)C#N

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Specifications

PubChem CID	7537603
CAS	727733-92-8
Molecular Weight (g/mol)	200.285
MDL Number	MFCD06796182
SMILES	C1CCN(CC1)CC2=CC=C(C=C2)C#N
Synonym	4-piperidin-1-ylmethyl benzonitrile,1-4-cyanobenzyl piperidine,4-piperidinomethyl benzonitrile,4-piperidylmethyl benzenecarbonitrile,4-piperidin-1-ylmethyl-benzonitrile,benzonitrile,4-1-piperidinylmethyl
IUPAC Name	4-(piperidin-1-ylmethyl)benzonitrile
InChI Key	JOGVBKNLRQCYKS-UHFFFAOYSA-N
Molecular Formula	C13H16N2

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