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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3,331 – 3,345 of 219,023 results

3,331

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Picolinic acid N-oxide, 97%

CAS: 824-40-8 Molecular Formula: C₆H₅NO₃ Molecular Weight (g/mol): 139.11 MDL Number: MFCD00006198 InChI Key: FHYMLBVGNFVFBT-UHFFFAOYSA-N Synonym: picolinic acid n-oxide,2-carboxypyridin-1-ium-1-olate,pyridine-2-carboxylic acid 1-oxide,picolinic acid 1-oxide,2-carboxypyridine n-oxide,2-pyridinecarboxylic acid, 1-oxide,chembl73173,2-pyridinecarboxylicacid, 1-oxide,picolinate n-oxide,1-oxopicolinic acid PubChem CID: 69986 IUPAC Name: 1-oxidopyridin-1-ium-2-carboxylic acid SMILES: C1=CC=[N+](C(=C1)C(=O)O)[O-]

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Specifications

PubChem CID	69986
CAS	824-40-8
Molecular Weight (g/mol)	139.11
MDL Number	MFCD00006198
SMILES	C1=CC=[N+](C(=C1)C(=O)O)[O-]
Synonym	picolinic acid n-oxide,2-carboxypyridin-1-ium-1-olate,pyridine-2-carboxylic acid 1-oxide,picolinic acid 1-oxide,2-carboxypyridine n-oxide,2-pyridinecarboxylic acid, 1-oxide,chembl73173,2-pyridinecarboxylicacid, 1-oxide,picolinate n-oxide,1-oxopicolinic acid
IUPAC Name	1-oxidopyridin-1-ium-2-carboxylic acid
InChI Key	FHYMLBVGNFVFBT-UHFFFAOYSA-N
Molecular Formula	C₆H₅NO₃

3,332

4-(Phenylazo)Diphenylamine, Sigma-Aldrich

CAS: 101-75-7 Molecular Weight (g/mol): 273.33 g/mol

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Specifications

CAS	101-75-7
Molecular Weight (g/mol)	273.33 g/mol

3,333

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5-Phenyl-1H-tetrazole, 99%

CAS: 18039-42-4 Molecular Formula: C7H6N4 Molecular Weight (g/mol): 146.153 MDL Number: MFCD00022388 InChI Key: MARUHZGHZWCEQU-UHFFFAOYSA-N Synonym: 5-phenyl-1h-tetrazole,5-phenyltetrazole,1h-tetrazole, 5-phenyl,2h-tetrazole, 5-phenyl,phenyltetrazole,5-phenyl tetrazole,expandex 5pt,expandex ox 5pt,kempore 50xpt,5-phenyltetrazole van PubChem CID: 87425 IUPAC Name: 5-phenyl-2H-tetrazole SMILES: C1=CC=C(C=C1)C2=NNN=N2

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Specifications

PubChem CID	87425
CAS	18039-42-4
Molecular Weight (g/mol)	146.153
MDL Number	MFCD00022388
SMILES	C1=CC=C(C=C1)C2=NNN=N2
Synonym	5-phenyl-1h-tetrazole,5-phenyltetrazole,1h-tetrazole, 5-phenyl,2h-tetrazole, 5-phenyl,phenyltetrazole,5-phenyl tetrazole,expandex 5pt,expandex ox 5pt,kempore 50xpt,5-phenyltetrazole van
IUPAC Name	5-phenyl-2H-tetrazole
InChI Key	MARUHZGHZWCEQU-UHFFFAOYSA-N
Molecular Formula	C7H6N4

3,334

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4-(4-Methyl-1-piperazinyl)aniline, 97%

CAS: 16153-81-4 Molecular Formula: C11H18N3 Molecular Weight (g/mol): 192.29 MDL Number: MFCD00172703 InChI Key: MOZNZNKHRXRLLF-UHFFFAOYSA-O Synonym: 4-4-methylpiperazino aniline,4-4-methylpiperazin-1-yl aniline,4-methyl-1-4-aminophenyl piperazine,4-4-methyl-1-piperazinyl aniline,4-4-methylpiperazin-1-yl phenylamine,1-4-aminophenyl-4-methylpiperazine,4-4-methyl-piperazin-1-yl-phenylamine,4-4-methylpiperazin-1-yl benzenamine,benzenamine, 4-4-methyl-1-piperazinyl,4-4-methylpiperazinyl phenylamine PubChem CID: 737253 IUPAC Name: 4-(4-methylpiperazin-1-yl)aniline SMILES: C[NH+]1CCN(CC1)C1=CC=C(N)C=C1

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Specifications

PubChem CID	737253
CAS	16153-81-4
Molecular Weight (g/mol)	192.29
MDL Number	MFCD00172703
SMILES	C[NH+]1CCN(CC1)C1=CC=C(N)C=C1
Synonym	4-4-methylpiperazino aniline,4-4-methylpiperazin-1-yl aniline,4-methyl-1-4-aminophenyl piperazine,4-4-methyl-1-piperazinyl aniline,4-4-methylpiperazin-1-yl phenylamine,1-4-aminophenyl-4-methylpiperazine,4-4-methyl-piperazin-1-yl-phenylamine,4-4-methylpiperazin-1-yl benzenamine,benzenamine, 4-4-methyl-1-piperazinyl,4-4-methylpiperazinyl phenylamine
IUPAC Name	4-(4-methylpiperazin-1-yl)aniline
InChI Key	MOZNZNKHRXRLLF-UHFFFAOYSA-O
Molecular Formula	C11H18N3

3,335

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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

3,336

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6-Bromopiperonal, 98%

CAS: 15930-53-7 Molecular Formula: C8H5BrO3 Molecular Weight (g/mol): 229.03 MDL Number: MFCD00022952 InChI Key: CSQUXTSIDQURDV-UHFFFAOYSA-N Synonym: 6-bromopiperonal,6-bromo-benzo 1,3 dioxole-5-carbaldehyde,2-bromo-4,5-methylenedioxybenzaldehyde,piperonal, 6-bromo,6-bromobenzo d 1,3 dioxole-5-carbaldehyde,6-bromo-1,3-benzodioxole-5-carboxaldehyde,6-bromo-2h-1,3-benzodioxole-5-carbaldehyde,1,3-benzodioxole-5-carboxaldehyde, 6-bromo,6-bromobenzo 1,3 dioxole-5-carbaldehyde,benzaldehyde, 2-bromo-4,5-methylenedioxy PubChem CID: 95062 SMILES: BrC1=CC2=C(OCO2)C=C1C=O

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Specifications

PubChem CID	95062
CAS	15930-53-7
Molecular Weight (g/mol)	229.03
MDL Number	MFCD00022952
SMILES	BrC1=CC2=C(OCO2)C=C1C=O
Synonym	6-bromopiperonal,6-bromo-benzo 1,3 dioxole-5-carbaldehyde,2-bromo-4,5-methylenedioxybenzaldehyde,piperonal, 6-bromo,6-bromobenzo d 1,3 dioxole-5-carbaldehyde,6-bromo-1,3-benzodioxole-5-carboxaldehyde,6-bromo-2h-1,3-benzodioxole-5-carbaldehyde,1,3-benzodioxole-5-carboxaldehyde, 6-bromo,6-bromobenzo 1,3 dioxole-5-carbaldehyde,benzaldehyde, 2-bromo-4,5-methylenedioxy
InChI Key	CSQUXTSIDQURDV-UHFFFAOYSA-N
Molecular Formula	C8H5BrO3

3,337

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1-(3-Chloro-2-pyridyl)piperazine, 98%

CAS: 87394-55-6 Molecular Formula: C9H12ClN3 Molecular Weight (g/mol): 197.666 MDL Number: MFCD08061034 InChI Key: HLCPXCHNWZGOMT-UHFFFAOYSA-N Synonym: 1-3-chloropyridin-2-yl piperazine,1-3-chloro-2-pyridyl piperazine,1-3-chloro-pyridin-2-yl-piperazine,1-3-chloro-2-pyridinyl piperazine,acmc-20apbr,3-chloro-2-pyridyl piperazine,n 3-chloropyridin-2-yl-piperazine,n-3-chloropyridin-2-yl-piperazine,piperazine,1-3-chloro-2-pyridinyl PubChem CID: 11412944 IUPAC Name: 1-(3-chloropyridin-2-yl)piperazine SMILES: C1CN(CCN1)C2=C(C=CC=N2)Cl

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Specifications

PubChem CID	11412944
CAS	87394-55-6
Molecular Weight (g/mol)	197.666
MDL Number	MFCD08061034
SMILES	C1CN(CCN1)C2=C(C=CC=N2)Cl
Synonym	1-3-chloropyridin-2-yl piperazine,1-3-chloro-2-pyridyl piperazine,1-3-chloro-pyridin-2-yl-piperazine,1-3-chloro-2-pyridinyl piperazine,acmc-20apbr,3-chloro-2-pyridyl piperazine,n 3-chloropyridin-2-yl-piperazine,n-3-chloropyridin-2-yl-piperazine,piperazine,1-3-chloro-2-pyridinyl
IUPAC Name	1-(3-chloropyridin-2-yl)piperazine
InChI Key	HLCPXCHNWZGOMT-UHFFFAOYSA-N
Molecular Formula	C9H12ClN3

3,338

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3,5-Dimethylbenzo[b]thiophene, 97%

CAS: 1964-45-0 Molecular Formula: C10H10S Molecular Weight (g/mol): 162.25 MDL Number: MFCD00052744 InChI Key: UQJSHXYNNVEGMQ-UHFFFAOYSA-N Synonym: 3,5-dimethylbenzo b thiophene,3,5-dimethyl-benzo b thiophene,3,5-dimethylbenzothiophene,3,5-dimethylthianapthene,benzo b thiophene, 3,5-dimethyl,3,5-dimethyl benzo b thiophene,3,5-dimethyl benzothiophene PubChem CID: 2779875 IUPAC Name: 3,5-dimethyl-1-benzothiophene SMILES: CC1=CC2=C(C=C1)SC=C2C

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Specifications

PubChem CID	2779875
CAS	1964-45-0
Molecular Weight (g/mol)	162.25
MDL Number	MFCD00052744
SMILES	CC1=CC2=C(C=C1)SC=C2C
Synonym	3,5-dimethylbenzo b thiophene,3,5-dimethyl-benzo b thiophene,3,5-dimethylbenzothiophene,3,5-dimethylthianapthene,benzo b thiophene, 3,5-dimethyl,3,5-dimethyl benzo b thiophene,3,5-dimethyl benzothiophene
IUPAC Name	3,5-dimethyl-1-benzothiophene
InChI Key	UQJSHXYNNVEGMQ-UHFFFAOYSA-N
Molecular Formula	C10H10S

3,339

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2-Chloro-N,N-dimethylnicotinamide, 97%

CAS: 52943-21-2 Molecular Formula: C8H9ClN2O Molecular Weight (g/mol): 184.623 MDL Number: MFCD08593346 InChI Key: QNZRJGJNLOMEGJ-UHFFFAOYSA-N Synonym: 2-chloro-n,n-dimethylnicotinamide,2-chloro-n,n-dimethyl-nicotinamide,2-chloropyridine-3-carboxylic acid n,n-dimethylamide,2-chloro-n,n-dimethyl-pyridine-3-carboxamide,2-chloro-n,n'-dimethylnicotinamide,3-pyridinecarboxamide,2-chloro-n,n-dimethyl,2-chloro 3-pyridyl-n,n-dimethylcarboxamide,n,n-dimethyl-2-chloro-3-pyridinecarboxamide PubChem CID: 10965214 IUPAC Name: 2-chloro-N,N-dimethylpyridine-3-carboxamide SMILES: CN(C)C(=O)C1=C(N=CC=C1)Cl

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Specifications

PubChem CID	10965214
CAS	52943-21-2
Molecular Weight (g/mol)	184.623
MDL Number	MFCD08593346
SMILES	CN(C)C(=O)C1=C(N=CC=C1)Cl
Synonym	2-chloro-n,n-dimethylnicotinamide,2-chloro-n,n-dimethyl-nicotinamide,2-chloropyridine-3-carboxylic acid n,n-dimethylamide,2-chloro-n,n-dimethyl-pyridine-3-carboxamide,2-chloro-n,n'-dimethylnicotinamide,3-pyridinecarboxamide,2-chloro-n,n-dimethyl,2-chloro 3-pyridyl-n,n-dimethylcarboxamide,n,n-dimethyl-2-chloro-3-pyridinecarboxamide
IUPAC Name	2-chloro-N,N-dimethylpyridine-3-carboxamide
InChI Key	QNZRJGJNLOMEGJ-UHFFFAOYSA-N
Molecular Formula	C8H9ClN2O

3,340

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2-Phenylindole, 95%

CAS: 948-65-2 Molecular Formula: C14H11N Molecular Weight (g/mol): 193.249 MDL Number: MFCD00005608 InChI Key: KLLLJCACIRKBDT-UHFFFAOYSA-N Synonym: 2-phenylindole,1h-indole, 2-phenyl,indole, 2-phenyl,stabilizer i,alpha-phenylindole,2-phenyl indole,phenylindole,unii-mqd44hv3p1,.alpha.-phenylindole,mqd44hv3p1 PubChem CID: 13698 IUPAC Name: 2-phenyl-1H-indole SMILES: C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2

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Specifications

PubChem CID	13698
CAS	948-65-2
Molecular Weight (g/mol)	193.249
MDL Number	MFCD00005608
SMILES	C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2
Synonym	2-phenylindole,1h-indole, 2-phenyl,indole, 2-phenyl,stabilizer i,alpha-phenylindole,2-phenyl indole,phenylindole,unii-mqd44hv3p1,.alpha.-phenylindole,mqd44hv3p1
IUPAC Name	2-phenyl-1H-indole
InChI Key	KLLLJCACIRKBDT-UHFFFAOYSA-N
Molecular Formula	C14H11N

3,341

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5-Chloromethyl-2-(1H-pyrazol-1-yl)pyridine, 97%, Thermo Scientific Chemicals

CAS: 748796-39-6 Molecular Formula: C9H8ClN3 Molecular Weight (g/mol): 193.634 MDL Number: MFCD06658399 InChI Key: QVDLCABKNWXXQF-UHFFFAOYSA-N PubChem CID: 16655946 IUPAC Name: 5-(chloromethyl)-2-pyrazol-1-ylpyridine SMILES: C1=CN(N=C1)C2=NC=C(C=C2)CCl

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Specifications

PubChem CID	16655946
CAS	748796-39-6
Molecular Weight (g/mol)	193.634
MDL Number	MFCD06658399
SMILES	C1=CN(N=C1)C2=NC=C(C=C2)CCl
IUPAC Name	5-(chloromethyl)-2-pyrazol-1-ylpyridine
InChI Key	QVDLCABKNWXXQF-UHFFFAOYSA-N
Molecular Formula	C9H8ClN3

3,342

7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydrobenzo[b]furan, 95%, Thermo Scientific™

CAS: 934586-50-2 Molecular Formula: C14H19BO3 Molecular Weight (g/mol): 246.11 MDL Number: MFCD11109314 InChI Key: HCAAUTYLSSDHFV-UHFFFAOYSA-N Synonym: 2-2,3-dihydrobenzofuran-7-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,7-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2,3-dihydrobenzo b furan,2,3-dihydrobenzofuran-7-boronic acid, pinacol ester,2-2,3-dihydro-1-benzofuran-7-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,7-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-2,3-dihydro-benzofuran,7-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2,3-dihydro-1-benzofuran,2,3-dihydrobenzo b furan-7-boronic acid pinacol ester,2-2,3-dihydrobenzo 2,3-b furan-7-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane PubChem CID: 43811027 IUPAC Name: 2-(2,3-dihydro-1-benzofuran-7-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1=C2OCCC2=CC=C1

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Specifications

PubChem CID	43811027
CAS	934586-50-2
Molecular Weight (g/mol)	246.11
MDL Number	MFCD11109314
SMILES	CC1(C)OB(OC1(C)C)C1=C2OCCC2=CC=C1
Synonym	2-2,3-dihydrobenzofuran-7-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,7-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2,3-dihydrobenzo b furan,2,3-dihydrobenzofuran-7-boronic acid, pinacol ester,2-2,3-dihydro-1-benzofuran-7-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,7-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-2,3-dihydro-benzofuran,7-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2,3-dihydro-1-benzofuran,2,3-dihydrobenzo b furan-7-boronic acid pinacol ester,2-2,3-dihydrobenzo 2,3-b furan-7-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC Name	2-(2,3-dihydro-1-benzofuran-7-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI Key	HCAAUTYLSSDHFV-UHFFFAOYSA-N
Molecular Formula	C14H19BO3

3,343

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Gibberellic acid, 90+%

CAS: 77-06-5 Molecular Formula: C19H22O6 Molecular Weight (g/mol): 346.38 MDL Number: MFCD00079329 InChI Key: IXORZMNAPKEEDV-QTWFBFKQSA-N Synonym: gibberellic acid,gibberellin a3,gibberellin,gibreskol,brellin,cekugib,grocel,gibberellin x,gibberellic acid ga3,gib-tabs PubChem CID: 91757643 IUPAC Name: (1R,2R,5S,8S,9S,10R,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadec-13-ene-9-carboxylic acid SMILES: CC12[C@H]3[C@H](C(O)=O)[C@@]45CC(=C)[C@@](O)(C4)CC[C@H]5[C@]3(OC1=O)C=C[C@@H]2O

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Specifications

PubChem CID	91757643
CAS	77-06-5
Molecular Weight (g/mol)	346.38
MDL Number	MFCD00079329
SMILES	CC12[C@H]3[C@H](C(O)=O)[C@@]45CC(=C)[C@@](O)(C4)CC[C@H]5[C@]3(OC1=O)C=C[C@@H]2O
Synonym	gibberellic acid,gibberellin a3,gibberellin,gibreskol,brellin,cekugib,grocel,gibberellin x,gibberellic acid ga3,gib-tabs
IUPAC Name	(1R,2R,5S,8S,9S,10R,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadec-13-ene-9-carboxylic acid
InChI Key	IXORZMNAPKEEDV-QTWFBFKQSA-N
Molecular Formula	C19H22O6

3,344

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2-Amino-5-methylthiazole, 98+%

CAS: 7305-71-7 Molecular Formula: C4H6N2S Molecular Weight (g/mol): 114.166 MDL Number: MFCD00078317 InChI Key: GUABFMPMKJGSBQ-UHFFFAOYSA-N Synonym: 2-amino-5-methylthiazole,5-methylthiazol-2-amine,2-thiazolamine, 5-methyl,2-amino-5-methyl-thiazole,thiazole, 2-amino-5-methyl,5-methyl-2-thiazolamine,5-methyl-2-aminothiazole,unii-7rab78af2p,2-amino-5-methyl thiazole,meloxicam related compound b PubChem CID: 351770 IUPAC Name: 5-methyl-1,3-thiazol-2-amine SMILES: CC1=CN=C(S1)N

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Specifications

PubChem CID	351770
CAS	7305-71-7
Molecular Weight (g/mol)	114.166
MDL Number	MFCD00078317
SMILES	CC1=CN=C(S1)N
Synonym	2-amino-5-methylthiazole,5-methylthiazol-2-amine,2-thiazolamine, 5-methyl,2-amino-5-methyl-thiazole,thiazole, 2-amino-5-methyl,5-methyl-2-thiazolamine,5-methyl-2-aminothiazole,unii-7rab78af2p,2-amino-5-methyl thiazole,meloxicam related compound b
IUPAC Name	5-methyl-1,3-thiazol-2-amine
InChI Key	GUABFMPMKJGSBQ-UHFFFAOYSA-N
Molecular Formula	C4H6N2S

3,345

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4-Amino-3,5-difluoropyridine, 97%

CAS: 159783-22-9 Molecular Formula: C₅H₄F₂N₂ Molecular Weight (g/mol): 130.1 InChI Key: XWAOYJHUAQFFMT-UHFFFAOYSA-N PubChem CID: 2737654 IUPAC Name: 3,5-difluoropyridin-4-amine SMILES: C1=C(C(=C(C=N1)F)N)F

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Specifications

PubChem CID	2737654
CAS	159783-22-9
Molecular Weight (g/mol)	130.1
SMILES	C1=C(C(=C(C=N1)F)N)F
IUPAC Name	3,5-difluoropyridin-4-amine
InChI Key	XWAOYJHUAQFFMT-UHFFFAOYSA-N
Molecular Formula	C₅H₄F₂N₂

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