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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4,156 – 4,170 of 268,062 results

4,156

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2-Amino-6-bromopurine, 98%

CAS: 82499-03-4 Molecular Formula: C5H4BrN5 Molecular Weight (g/mol): 214.026 MDL Number: MFCD01321309 InChI Key: HPGBGNVPUMCKPM-UHFFFAOYSA-N Synonym: 2-amino-6-bromopurine,6-bromo-9h-purin-2-amine,1h-purin-2-amine, 6-bromo,6-bromoguanine,d2-amino-6-bromopurine,6-bromopurine-2-ylamine,purine, 2-amino-6-bromo,6-bromo-9h-purin-2-ylamine,9h-purin-2-amine,6-bromo PubChem CID: 6101139 IUPAC Name: 6-bromo-7H-purin-2-amine SMILES: C1=NC2=C(N1)C(=NC(=N2)N)Br

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PubChem CID	6101139
CAS	82499-03-4
Molecular Weight (g/mol)	214.026
MDL Number	MFCD01321309
SMILES	C1=NC2=C(N1)C(=NC(=N2)N)Br
Synonym	2-amino-6-bromopurine,6-bromo-9h-purin-2-amine,1h-purin-2-amine, 6-bromo,6-bromoguanine,d2-amino-6-bromopurine,6-bromopurine-2-ylamine,purine, 2-amino-6-bromo,6-bromo-9h-purin-2-ylamine,9h-purin-2-amine,6-bromo
IUPAC Name	6-bromo-7H-purin-2-amine
InChI Key	HPGBGNVPUMCKPM-UHFFFAOYSA-N
Molecular Formula	C5H4BrN5

4,157

6-amino-1,3-benzoxazol-2(3h)-one, 95%, Thermo Scientific™

CAS: 22876-17-1 Molecular Formula: C7H6N2O2 Molecular Weight (g/mol): 150.137 MDL Number: MFCD00463899 InChI Key: STLPJYGZOIEDAJ-UHFFFAOYSA-N Synonym: 6-aminobenzo d oxazol-2 3h-one,6-amino-1,3-benzoxazol-2 3h-one,2 3h-benzoxazolone, 6-amino,6-amino-2-3h benzoxazolone,6-amino-3h-benzooxazol-2-one,6-amino-2,3-dihydro-1,3-benzoxazol-2-one,6-amino-2-benzoxazolone,6-amino-2-benzoxazolinone,6-amino-3-hydrobenzoxazol-2-one,6-amino-2-hydroxybenzoxazole PubChem CID: 826989 IUPAC Name: 6-amino-3H-1,3-benzoxazol-2-one SMILES: C1=CC2=C(C=C1N)OC(=O)N2

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PubChem CID	826989
CAS	22876-17-1
Molecular Weight (g/mol)	150.137
MDL Number	MFCD00463899
SMILES	C1=CC2=C(C=C1N)OC(=O)N2
Synonym	6-aminobenzo d oxazol-2 3h-one,6-amino-1,3-benzoxazol-2 3h-one,2 3h-benzoxazolone, 6-amino,6-amino-2-3h benzoxazolone,6-amino-3h-benzooxazol-2-one,6-amino-2,3-dihydro-1,3-benzoxazol-2-one,6-amino-2-benzoxazolone,6-amino-2-benzoxazolinone,6-amino-3-hydrobenzoxazol-2-one,6-amino-2-hydroxybenzoxazole
IUPAC Name	6-amino-3H-1,3-benzoxazol-2-one
InChI Key	STLPJYGZOIEDAJ-UHFFFAOYSA-N
Molecular Formula	C7H6N2O2

4,158

Pentafluorophenyl 6-phenylnicotinate, 97%, Thermo Scientific™

CAS: 934570-41-9 Molecular Formula: C18H8F5NO2 Molecular Weight (g/mol): 365.26 MDL Number: MFCD09702345 InChI Key: YUPUNKGUYBKZST-UHFFFAOYSA-N Synonym: pentafluorophenyl 6-phenylnicotinate,pentafluorophenyl 2-phenylpyridine-5-carboxylate,pentafluorophenyl 6-phenylpyridine-3-carboxylate,2,3,4,5,6-pentakis fluoranyl phenyl 6-phenylpyridine-3-carboxylate,6-phenyl-3-pyridinecarboxylic acid 2,3,4,5,6-pentafluorophenyl ester PubChem CID: 24229464 IUPAC Name: (2,3,4,5,6-pentafluorophenyl) 6-phenylpyridine-3-carboxylate SMILES: FC1=C(F)C(F)=C(OC(=O)C2=CN=C(C=C2)C2=CC=CC=C2)C(F)=C1F

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Specifications

PubChem CID	24229464
CAS	934570-41-9
Molecular Weight (g/mol)	365.26
MDL Number	MFCD09702345
SMILES	FC1=C(F)C(F)=C(OC(=O)C2=CN=C(C=C2)C2=CC=CC=C2)C(F)=C1F
Synonym	pentafluorophenyl 6-phenylnicotinate,pentafluorophenyl 2-phenylpyridine-5-carboxylate,pentafluorophenyl 6-phenylpyridine-3-carboxylate,2,3,4,5,6-pentakis fluoranyl phenyl 6-phenylpyridine-3-carboxylate,6-phenyl-3-pyridinecarboxylic acid 2,3,4,5,6-pentafluorophenyl ester
IUPAC Name	(2,3,4,5,6-pentafluorophenyl) 6-phenylpyridine-3-carboxylate
InChI Key	YUPUNKGUYBKZST-UHFFFAOYSA-N
Molecular Formula	C18H8F5NO2

4,159

4-(thien-2-ylmethyl)aniline, Thermo Scientific™

CAS: 129136-65-8 Molecular Formula: C11H11NS Molecular Weight (g/mol): 189.276 InChI Key: PIJZLXNJWCKMSA-UHFFFAOYSA-N Synonym: 4-thien-2-ylmethyl aniline,4-thiophen-2-ylmethyl aniline,4-thiophen-2-yl methyl aniline,4-2-thienylmethyl phenylamine PubChem CID: 20063869 IUPAC Name: 4-(thiophen-2-ylmethyl)aniline SMILES: C1=CSC(=C1)CC2=CC=C(C=C2)N

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Specifications

PubChem CID	20063869
CAS	129136-65-8
Molecular Weight (g/mol)	189.276
SMILES	C1=CSC(=C1)CC2=CC=C(C=C2)N
Synonym	4-thien-2-ylmethyl aniline,4-thiophen-2-ylmethyl aniline,4-thiophen-2-yl methyl aniline,4-2-thienylmethyl phenylamine
IUPAC Name	4-(thiophen-2-ylmethyl)aniline
InChI Key	PIJZLXNJWCKMSA-UHFFFAOYSA-N
Molecular Formula	C11H11NS

4,160

[3-(2-Furyl)-1-methyl-1H-pyrazol-5-yl]methanol 97+%, Thermo Scientific™

CAS: 886851-33-8 Molecular Formula: C9H10N2O2 Molecular Weight (g/mol): 178.191 InChI Key: BYXYWFXMSJTOKB-UHFFFAOYSA-N Synonym: 3-2-furyl-1-methyl-1h-pyrazol-5-yl methanol,5-furan-2-yl-2-methylpyrazol-3-yl methanol,3-2-furyl-1-methylpyrazol-5-yl methan-1-ol,3-furan-2-yl-1-methyl-1h-pyrazol-5-yl methanol PubChem CID: 18525804 IUPAC Name: [5-(furan-2-yl)-2-methylpyrazol-3-yl]methanol SMILES: CN1C(=CC(=N1)C2=CC=CO2)CO

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Specifications

PubChem CID	18525804
CAS	886851-33-8
Molecular Weight (g/mol)	178.191
SMILES	CN1C(=CC(=N1)C2=CC=CO2)CO
Synonym	3-2-furyl-1-methyl-1h-pyrazol-5-yl methanol,5-furan-2-yl-2-methylpyrazol-3-yl methanol,3-2-furyl-1-methylpyrazol-5-yl methan-1-ol,3-furan-2-yl-1-methyl-1h-pyrazol-5-yl methanol
IUPAC Name	[5-(furan-2-yl)-2-methylpyrazol-3-yl]methanol
InChI Key	BYXYWFXMSJTOKB-UHFFFAOYSA-N
Molecular Formula	C9H10N2O2

4,161

N-Methyl-(tetrahydropyran-4-ylmethyl)amine, 97%, Thermo Scientific™

CAS: 439081-52-4 Molecular Formula: C7H15NO Molecular Weight (g/mol): 129.20 MDL Number: MFCD06739009 InChI Key: WMBCUXKYKVTJRF-UHFFFAOYSA-N Synonym: methyl oxan-4-ylmethyl amine,methyl-tetrahydropyran-4-ylmethyl amine,n-methyl-1-tetrahydro-2h-pyran-4-yl methanamine,methyl-tetrahydro-pyran-4-ylmethyl-amine,n-methyl-tetrahydropyran-4-ylmethyl amine,4-methylamino methyl tetrahydropyran,2h-pyran-4-methanamine, tetrahydro-n-methyl,n-methyl-1-tetrahydro-2h-pyran-4-yl methylamine,n-methyl tetrahydro-2h-pyran-4-yl methanamine,4-methylamino methyl tetrahydro-2h-pyran PubChem CID: 22225668 IUPAC Name: N-methyl-1-(oxan-4-yl)methanamine SMILES: CNCC1CCOCC1

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Specifications

PubChem CID	22225668
CAS	439081-52-4
Molecular Weight (g/mol)	129.20
MDL Number	MFCD06739009
SMILES	CNCC1CCOCC1
Synonym	methyl oxan-4-ylmethyl amine,methyl-tetrahydropyran-4-ylmethyl amine,n-methyl-1-tetrahydro-2h-pyran-4-yl methanamine,methyl-tetrahydro-pyran-4-ylmethyl-amine,n-methyl-tetrahydropyran-4-ylmethyl amine,4-methylamino methyl tetrahydropyran,2h-pyran-4-methanamine, tetrahydro-n-methyl,n-methyl-1-tetrahydro-2h-pyran-4-yl methylamine,n-methyl tetrahydro-2h-pyran-4-yl methanamine,4-methylamino methyl tetrahydro-2h-pyran
IUPAC Name	N-methyl-1-(oxan-4-yl)methanamine
InChI Key	WMBCUXKYKVTJRF-UHFFFAOYSA-N
Molecular Formula	C7H15NO

4,162

(3-Piperidinophenyl)methanol, 97%, Thermo Scientific™

CAS: 852180-58-6 Molecular Formula: C12H17NO Molecular Weight (g/mol): 191.274 MDL Number: MFCD07772816 InChI Key: HNESBVGXCDQHLJ-UHFFFAOYSA-N Synonym: 3-piperidinophenyl methanol,3-piperidin-1-yl phenyl methanol,3-piperidin-1-ylphenyl methanol,3-piperidylphenyl methan-1-ol,benzenemethanol,3-1-piperidinyl PubChem CID: 7162330 IUPAC Name: (3-piperidin-1-ylphenyl)methanol SMILES: C1CCN(CC1)C2=CC=CC(=C2)CO

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PubChem CID	7162330
CAS	852180-58-6
Molecular Weight (g/mol)	191.274
MDL Number	MFCD07772816
SMILES	C1CCN(CC1)C2=CC=CC(=C2)CO
Synonym	3-piperidinophenyl methanol,3-piperidin-1-yl phenyl methanol,3-piperidin-1-ylphenyl methanol,3-piperidylphenyl methan-1-ol,benzenemethanol,3-1-piperidinyl
IUPAC Name	(3-piperidin-1-ylphenyl)methanol
InChI Key	HNESBVGXCDQHLJ-UHFFFAOYSA-N
Molecular Formula	C12H17NO

4,163

Thieno[2,3-b]pyrazine-6-carboxylic acid, 90%, Thermo Scientific™

CAS: 59944-79-5 Molecular Formula: C7H4N2O2S Molecular Weight (g/mol): 180.181 InChI Key: MEHCDDSVVYRWJT-UHFFFAOYSA-N Synonym: thieno 2,3-b pyrazine-6-carboxylic acid,pubchem9882,thieno 2,3-b pyrazine-6-carboxylicacid,6-thieno 2,3-b pyrazinecarboxylic acid,thieno 3,2-b pyrazine-6-carboxylic acid,thiopheno 2,3-b pyrazine-6-carboxylic acid PubChem CID: 7164578 IUPAC Name: thieno[2,3-b]pyrazine-6-carboxylic acid SMILES: C1=CN=C2C(=N1)C=C(S2)C(=O)O

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Specifications

PubChem CID	7164578
CAS	59944-79-5
Molecular Weight (g/mol)	180.181
SMILES	C1=CN=C2C(=N1)C=C(S2)C(=O)O
Synonym	thieno 2,3-b pyrazine-6-carboxylic acid,pubchem9882,thieno 2,3-b pyrazine-6-carboxylicacid,6-thieno 2,3-b pyrazinecarboxylic acid,thieno 3,2-b pyrazine-6-carboxylic acid,thiopheno 2,3-b pyrazine-6-carboxylic acid
IUPAC Name	thieno[2,3-b]pyrazine-6-carboxylic acid
InChI Key	MEHCDDSVVYRWJT-UHFFFAOYSA-N
Molecular Formula	C7H4N2O2S

4,164

1-(3-Isocyanatophenyl)-1H-pyrrole, ≥97%, Thermo Scientific™

CAS: 857283-59-1 Molecular Formula: C11H8N2O Molecular Weight (g/mol): 184.198 MDL Number: MFCD07772799 InChI Key: PUPFPJGLDBUOOI-UHFFFAOYSA-N Synonym: 1-3-isocyanatophenyl-1h-pyrrole,1-3-isocyanatophenyl pyrrole,3-pyrrolylbenzenisocyanate,1h-pyrrole,1-3-isocyanatophenyl PubChem CID: 7162333 IUPAC Name: 1-(3-isocyanatophenyl)pyrrole SMILES: C1=CN(C=C1)C2=CC=CC(=C2)N=C=O

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PubChem CID	7162333
CAS	857283-59-1
Molecular Weight (g/mol)	184.198
MDL Number	MFCD07772799
SMILES	C1=CN(C=C1)C2=CC=CC(=C2)N=C=O
Synonym	1-3-isocyanatophenyl-1h-pyrrole,1-3-isocyanatophenyl pyrrole,3-pyrrolylbenzenisocyanate,1h-pyrrole,1-3-isocyanatophenyl
IUPAC Name	1-(3-isocyanatophenyl)pyrrole
InChI Key	PUPFPJGLDBUOOI-UHFFFAOYSA-N
Molecular Formula	C11H8N2O

4,165

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Pyridinium p-toluenesulfonate, 98%

CAS: 24057-28-1 Molecular Formula: C₁₂H₁₃NO₃S Molecular Weight (g/mol): 251.3 MDL Number: MFCD00013108 Synonym: pyridinium p-toluenesulfonate,ppts,pyridin-1-ium 4-methylbenzenesulfonate,pyridinium 4-toluenesulfonate,pyridinium tosylate,pyridinium 4-methylbenzenesulfonate,pyridinium p-toluene sulfonate,pyridinium p-toluene sulphonate,pyridinium para-toluenesulfonate,4-toluenesulfonic acid pyridine salt

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CAS	24057-28-1
Molecular Weight (g/mol)	251.3
MDL Number	MFCD00013108
Synonym	pyridinium p-toluenesulfonate,ppts,pyridin-1-ium 4-methylbenzenesulfonate,pyridinium 4-toluenesulfonate,pyridinium tosylate,pyridinium 4-methylbenzenesulfonate,pyridinium p-toluene sulfonate,pyridinium p-toluene sulphonate,pyridinium para-toluenesulfonate,4-toluenesulfonic acid pyridine salt
Molecular Formula	C₁₂H₁₃NO₃S

4,166

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1-Hexadecylpyridinium chloride monohydrate, 96.0-101.0%

CAS: 6004-24-6 Molecular Formula: C21H40ClNO Molecular Weight (g/mol): 358.01 MDL Number: MFCD00149977 InChI Key: NFCRBQADEGXVDL-UHFFFAOYSA-M Synonym: cetylpyridinium chloride monohydrate,1-hexadecylpyridin-1-ium chloride hydrate,1-hexadecylpyridinium chloride monohydrate,hexadecylpyridinium chloride monohydrate,unii-d9om4sk49p,pyridinium, 1-hexadecyl-, chloride, monohydrate,d9om4sk49p,cetylpyridinii chloridum,sprol tn PubChem CID: 22324 ChEBI: CHEBI:3566 IUPAC Name: 1-hexadecylpyridin-1-ium;chloride;hydrate SMILES: O.[Cl-].CCCCCCCCCCCCCCCCN1C=C[CH+]C=C1

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Specifications

PubChem CID	22324
CAS	6004-24-6
Molecular Weight (g/mol)	358.01
ChEBI	CHEBI:3566
MDL Number	MFCD00149977
SMILES	O.[Cl-].CCCCCCCCCCCCCCCCN1C=C[CH+]C=C1
Synonym	cetylpyridinium chloride monohydrate,1-hexadecylpyridin-1-ium chloride hydrate,1-hexadecylpyridinium chloride monohydrate,hexadecylpyridinium chloride monohydrate,unii-d9om4sk49p,pyridinium, 1-hexadecyl-, chloride, monohydrate,d9om4sk49p,cetylpyridinii chloridum,sprol tn
IUPAC Name	1-hexadecylpyridin-1-ium;chloride;hydrate
InChI Key	NFCRBQADEGXVDL-UHFFFAOYSA-M
Molecular Formula	C21H40ClNO

4,167

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3,5-Lutidine, 99%

CAS: 591-22-0 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.156 MDL Number: MFCD00006404 InChI Key: HWWYDZCSSYKIAD-UHFFFAOYSA-N Synonym: 3,5-lutidine,pyridine, 3,5-dimethyl,unii-6q4ypz045v,3,5-dimethyl pyridine,3,5 lutidine,3,5-lutdcine,3,5-dimethylpyridin,3,5-dimethyl-pyridine,acmc-1axev,dsstox_cid_30825 PubChem CID: 11565 IUPAC Name: 3,5-dimethylpyridine SMILES: CC1=CC(=CN=C1)C

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PubChem CID	11565
CAS	591-22-0
Molecular Weight (g/mol)	107.156
MDL Number	MFCD00006404
SMILES	CC1=CC(=CN=C1)C
Synonym	3,5-lutidine,pyridine, 3,5-dimethyl,unii-6q4ypz045v,3,5-dimethyl pyridine,3,5 lutidine,3,5-lutdcine,3,5-dimethylpyridin,3,5-dimethyl-pyridine,acmc-1axev,dsstox_cid_30825
IUPAC Name	3,5-dimethylpyridine
InChI Key	HWWYDZCSSYKIAD-UHFFFAOYSA-N
Molecular Formula	C7H9N

4,168

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4-Amino-1-benzylpiperidine, 98%

CAS: 50541-93-0 Molecular Formula: C₁₂H₁₈N₂ Molecular Weight (g/mol): 190.29 MDL Number: MFCD00006504 InChI Key: YUBDLZGUSSWQSS-UHFFFAOYSA-N Synonym: 4-amino-1-benzylpiperidine,1-benzyl-4-aminopiperidine,1-benzyl-piperidin-4-ylamine,n-benzyl-4-amino piperidine,1-benzyl-4-piperidylamine,4-piperidinamine, 1-phenylmethyl,4-amino-1-n-benzylpiperidine,4-amino-n-benzylpiperidine,1-phenylmethyl-4-piperidinamine,n-benzyl-4-aminopiperidine PubChem CID: 415852 IUPAC Name: 1-benzylpiperidin-4-amine SMILES: C1CN(CCC1N)CC2=CC=CC=C2

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PubChem CID	415852
CAS	50541-93-0
Molecular Weight (g/mol)	190.29
MDL Number	MFCD00006504
SMILES	C1CN(CCC1N)CC2=CC=CC=C2
Synonym	4-amino-1-benzylpiperidine,1-benzyl-4-aminopiperidine,1-benzyl-piperidin-4-ylamine,n-benzyl-4-amino piperidine,1-benzyl-4-piperidylamine,4-piperidinamine, 1-phenylmethyl,4-amino-1-n-benzylpiperidine,4-amino-n-benzylpiperidine,1-phenylmethyl-4-piperidinamine,n-benzyl-4-aminopiperidine
IUPAC Name	1-benzylpiperidin-4-amine
InChI Key	YUBDLZGUSSWQSS-UHFFFAOYSA-N
Molecular Formula	C₁₂H₁₈N₂

4,169

N-Methyl-N-[(1-methyl-1H-indol-6-yl)methyl]amine, 97%, Thermo Scientific™

CAS: 884507-20-4 Molecular Formula: C11H14N2 Molecular Weight (g/mol): 174.247 MDL Number: MFCD08690256 InChI Key: ODIDITAYVOGYIV-UHFFFAOYSA-N Synonym: n-methyl-n-1-methyl-1h-indol-6-yl methyl amine,methyl 1-methylindol-6-yl methyl amine,1h-indole-6-methanamine, n,1-dimethyl,n-methyl-1-1-methyl-1h-indol-6-yl methanamine,1h-indole-6-methanamine,n,1-dimethyl,methyl-1-methyl-1h-indol-6-ylmethyl-amine PubChem CID: 18525770 IUPAC Name: N-methyl-1-(1-methylindol-6-yl)methanamine SMILES: CNCC1=CC2=C(C=C1)C=CN2C

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Specifications

PubChem CID	18525770
CAS	884507-20-4
Molecular Weight (g/mol)	174.247
MDL Number	MFCD08690256
SMILES	CNCC1=CC2=C(C=C1)C=CN2C
Synonym	n-methyl-n-1-methyl-1h-indol-6-yl methyl amine,methyl 1-methylindol-6-yl methyl amine,1h-indole-6-methanamine, n,1-dimethyl,n-methyl-1-1-methyl-1h-indol-6-yl methanamine,1h-indole-6-methanamine,n,1-dimethyl,methyl-1-methyl-1h-indol-6-ylmethyl-amine
IUPAC Name	N-methyl-1-(1-methylindol-6-yl)methanamine
InChI Key	ODIDITAYVOGYIV-UHFFFAOYSA-N
Molecular Formula	C11H14N2

4,170

3-(2-Furyl)benzoic acid, 97%, Thermo Scientific™

CAS: 35461-99-5 Molecular Formula: C11H8O3 Molecular Weight (g/mol): 188.182 MDL Number: MFCD02690979 InChI Key: RQVVFGRDMHDHNI-UHFFFAOYSA-N Synonym: 3-furan-2-yl benzoic acid,3-2-furyl benzoic acid,3-fur-2-ylbenzoic acid,3-furan-2-yl-benzoic acid,m-2-furyl benzoic acid,benzoic acid, 3-2-furanyl PubChem CID: 5037933 IUPAC Name: 3-(furan-2-yl)benzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C2=CC=CO2

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Specifications

PubChem CID	5037933
CAS	35461-99-5
Molecular Weight (g/mol)	188.182
MDL Number	MFCD02690979
SMILES	C1=CC(=CC(=C1)C(=O)O)C2=CC=CO2
Synonym	3-furan-2-yl benzoic acid,3-2-furyl benzoic acid,3-fur-2-ylbenzoic acid,3-furan-2-yl-benzoic acid,m-2-furyl benzoic acid,benzoic acid, 3-2-furanyl
IUPAC Name	3-(furan-2-yl)benzoic acid
InChI Key	RQVVFGRDMHDHNI-UHFFFAOYSA-N
Molecular Formula	C11H8O3

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