2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one

C113H164ClN13O10 — CID 167628030

IUPAC2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one
SMILESCC(C)CC(=O)NC(C)C.CC(C)N1Cc2c(Cl)cccc2C1=O.CC(C)N1Cc2ncccc2C1=O.CC(C)NC(=O)CC1CCCCC1.CC(C)NC(=O)CCC1CCCCC1.CC(C)NC(=O)c1ccccc1.CCC#Cc1ccc2c(n1)CN(C(C)C)C2=O.CCCCc1ccc2c(n1)CN(C(C)C)C2=O.Cc1ccc(C(=O)NC(C)C)cc1.Cc1ccc2c(c1)C(=O)N(C(C)C)C2
InChIInChI=1S/C14H20N2O.C14H16N2O.C12H15NO.C12H23NO.C11H12ClNO.C11H15NO.C11H21NO.C10H12N2O.C10H13NO.C8H17NO/c2*1-4-5-6-11-7-8-12-13(15-11)9-16(10(2)3)14(12)17;1-8(2)13-7-10-5-4-9(3)6-11(10)12(13)14;1-10(2)13-12(14)9-8-11-6-4-3-5-7-11;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-8(2)12-11(13)10-6-4-9(3)5-7-10;1-9(2)12-11(13)8-10-6-4-3-5-7-10;1-7(2)12-6-9-8(10(12)13)4-3-5-11-9;1-8(2)11-10(12)9-6-4-3-5-7-9;1-6(2)5-8(10)9-7(3)4/h7-8,10H,4-6,9H2,1-3H3;7-8,10H,4,9H2,1-3H3;4-6,8H,7H2,1-3H3;10-11H,3-9H2,1-2H3,(H,13,14);3-5,7H,6H2,1-2H3;4-8H,1-3H3,(H,12,13);9-10H,3-8H2,1-2H3,(H,12,13);3-5,7H,6H2,1-2H3;3-8H,1-2H3,(H,11,12);6-7H,5H2,1-4H3,(H,9,10)
InChIKeyNJSMNFUMEKOZJO-UHFFFAOYSA-N
MW1900.09 g/mol
LogP22.37
Rot. Bonds22

About 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one

2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one (PubChem CID 167628030) has the molecular formula C113H164ClN13O10 and a molecular weight of 1900.09 g/mol. Its IUPAC name is 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one.

Molecular Properties

Compound Name2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one
PubChem CID167628030
Molecular FormulaC113H164ClN13O10
Molecular Weight1900.09 g/mol
Exact Mass1898.24
IUPAC Name2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one
SMILESCC(C)CC(=O)NC(C)C.CC(C)N1Cc2c(Cl)cccc2C1=O.CC(C)N1Cc2ncccc2C1=O.CC(C)NC(=O)CC1CCCCC1.CC(C)NC(=O)CCC1CCCCC1.CC(C)NC(=O)c1ccccc1.CCC#Cc1ccc2c(n1)CN(C(C)C)C2=O.CCCCc1ccc2c(n1)CN(C(C)C)C2=O.Cc1ccc(C(=O)NC(C)C)cc1.Cc1ccc2c(c1)C(=O)N(C(C)C)C2
InChIInChI=1S/C14H20N2O.C14H16N2O.C12H15NO.C12H23NO.C11H12ClNO.C11H15NO.C11H21NO.C10H12N2O.C10H13NO.C8H17NO/c2*1-4-5-6-11-7-8-12-13(15-11)9-16(10(2)3)14(12)17;1-8(2)13-7-10-5-4-9(3)6-11(10)12(13)14;1-10(2)13-12(14)9-8-11-6-4-3-5-7-11;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-8(2)12-11(13)10-6-4-9(3)5-7-10;1-9(2)12-11(13)8-10-6-4-3-5-7-10;1-7(2)12-6-9-8(10(12)13)4-3-5-11-9;1-8(2)11-10(12)9-6-4-3-5-7-9;1-6(2)5-8(10)9-7(3)4/h7-8,10H,4-6,9H2,1-3H3;7-8,10H,4,9H2,1-3H3;4-6,8H,7H2,1-3H3;10-11H,3-9H2,1-2H3,(H,13,14);3-5,7H,6H2,1-2H3;4-8H,1-3H3,(H,12,13);9-10H,3-8H2,1-2H3,(H,12,13);3-5,7H,6H2,1-2H3;3-8H,1-2H3,(H,11,12);6-7H,5H2,1-4H3,(H,9,10)
InChIKeyNJSMNFUMEKOZJO-UHFFFAOYSA-N
XLogP22.37
TPSA285.72 Ų
H-Bond Donors5
H-Bond Acceptors13
Rotatable Bonds22
Heavy Atoms137
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001900.09
LogP ≤ 522.37
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one with MolForge

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Related Compounds

5-[2-[(1S)-1-[[2-(3-acetyl-7-ethylindol-1-yl)acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;(4R)-1-[2,4-bis(difluoromethyl)pyrrol-1-yl]-4-[3-(7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]-5-(3,5-difluorophenyl)pentan-2-one;3-[2-[(1S)-1-[[2-(3-chlorophenyl)acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-N-methylbenzamide;5-[2-[(2R)-5-[2-cyclopropyl-4-(trifluoromethyl)pyrrol-1-yl]-1-(3,5-difluorophenyl)-4-oxoheptan-2-yl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(2R)-5-[3-(difluoromethyl)-4,4,7,7-tetrafluoro-5,6-dihydroindol-1-yl]-1-(3,5-difluorophenyl)-4-oxopentan-2-yl]-3-pyridinyl]-2-methyl-3H-isoindol-1-one
CID 157125572
4-(carbazol-9-ylmethyl)-3-chloro-N-hydroxybenzamide;4-(carbazol-9-ylmethyl)-3-cyano-N-hydroxybenzamide;5-(carbazol-9-ylmethyl)-N-hydroxypyridine-2-carboxamide;6-(carbazol-9-ylmethyl)-N-hydroxypyridine-3-carboxamide;4-(carbazol-9-ylmethyl)-N-hydroxy-3-(trifluoromethyl)benzamide;ethane
CID 158813240
(7S)-N-[3-amino-2-(methyliminomethyl)prop-2-enyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-(2-piperidin-1-ylethyl)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[(4-propanoylcyclohexyl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-7-propan-2-yl-N-(pyridin-2-ylmethyl)-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide
CID 158855925
2-[1-[2-(3-chloro-4-methylphenyl)acetyl]piperidin-4-yl]-2-[[4-(1H-indol-3-yl)cyclohexyl]amino]acetamide;2-[1-[2-[4-(1,1-difluoroethyl)phenyl]acetyl]piperidin-4-yl]-2-[[4-(1H-indol-3-yl)cyclohexyl]amino]acetamide;2-[1-[(E)-3-(4-fluoro-3-methylphenyl)prop-2-enoyl]piperidin-4-yl]-2-[[4-(1H-indol-3-yl)cyclohexyl]amino]acetamide;2-[1-[(E)-3-(2-fluorophenyl)prop-2-enoyl]piperidin-4-yl]-2-[[4-(1H-indol-3-yl)cyclohexyl]amino]acetamide;2-[[4-(1H-indol-3-yl)cyclohexyl]amino]-2-[1-[(E)-3-(3-methylphenyl)prop-2-enoyl]piperidin-4-yl]acetamide
CID 159547586
pentakis(carbon dioxide);N-[(1R)-1-(2-chloro-4-fluorophenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-(2-chloro-4-fluorophenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-(2-chloro-3-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2,3-dimethyl-1-[(4-phenylphenyl)methyl]-N-[(1S)-1-pyridin-3-ylethyl]indole-5-carboxamide;N-[(1R)-1-[4-fluoro-2-(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide
CID 160998935
(2'R,3S,3'S,5'S)-3'-(3-chloro-2-fluorophenyl)-5'-(2,2-dimethylpropyl)-N-[4-[4-[2-[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]ethynyl]piperidine-1-carbonyl]-1-bicyclo[2.2.2]octanyl]-6-(trifluoromethyl)spiro[1,2-dihydropyrrolo[3,2-c]pyridine-3,4'-pyrrolidine]-2'-carboxamide
CID 164591796
(2'R,3S,3'S,5'S)-3'-(3-chloro-2-fluorophenyl)-5'-(2,2-dimethylpropyl)-N-[4-[[4-[2-[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]ethynyl]piperidin-1-yl]methyl]-1-bicyclo[2.2.2]octanyl]-6-(trifluoromethyl)spiro[1,2-dihydropyrrolo[3,2-c]pyridine-3,4'-pyrrolidine]-2'-carboxamide
CID 164592098
H-D-Lys(nicotinoyl)(nicotinoyl)-Pro-2Pal-Pro-D-Phe(2,6-diCl)-Asn-D-Trp-Phe-D-Trp-Leu-Nle-NH2
CID 24868249
10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[1,2-b][2,6]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(4-methylbenzoyl)-3,10-dihydro-2H-imidazo[1,2-b][2,6]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(4-methylbenzoyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(6-methylpyridine-3-carbonyl)-3,10-dihydro-2H-imidazo[1,2-b][2,6]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(pyridine-3-carbonyl)-3,10-dihydro-2H-imidazo[1,2-b][2,6]naphthyridin-5-one
CID 157063887
5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;3-(2-methylphenyl)-N-propan-2-ylpropanamide;3-(3-methylphenyl)-N-propan-2-ylpropanamide;3-(4-methylphenyl)-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;3-phenyl-N-propan-2-ylpropanamide;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one
CID 157576893
(2R)-1-(6-acetyl-1H-indol-3-yl)-2-[2-(2-chloro-4-methylphenyl)ethylamino]-2-phenylethanone;bis((2S)-1-(6-acetyl-1H-indol-3-yl)-2-[2-(2-chloro-4-methylphenyl)ethylamino]-2-phenylethanone);bis(3-[(2R)-2-[2-(2-chloro-4-methylphenyl)ethylamino]-2-phenylacetyl]-N-propyl-1H-indole-7-carboxamide);bis(3-[(2S)-2-[2-(2-chloro-4-methylphenyl)ethylamino]-2-phenylacetyl]-N-propyl-1H-indole-7-carboxamide)
CID 157594822
hexakis(carbon dioxide);N-[(1S)-1-(5-chloro-3-pyridinyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(R)-cyclopropyl-(3-propan-2-ylphenyl)methyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2,3-dimethyl-N-[(1R)-3-methyl-1-(3-propan-2-ylphenyl)butyl]-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2,3-dimethyl-1-[(4-phenylphenyl)methyl]-N-[(1R)-1-(3-propan-2-ylphenyl)prop-2-ynyl]indole-5-carboxamide;N-[(1R)-2,2-dimethyl-1-(3-propan-2-ylphenyl)propyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-2,2-dimethyl-1-(3-propan-2-ylphenyl)propyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide
CID 157822364

Frequently Asked Questions

What is the IUPAC name of 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one?
The IUPAC name of 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one (CID 167628030) is 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one.
What is the SMILES notation for 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one?
The canonical SMILES for 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one is CC(C)CC(=O)NC(C)C.CC(C)N1Cc2c(Cl)cccc2C1=O.CC(C)N1Cc2ncccc2C1=O.CC(C)NC(=O)CC1CCCCC1.CC(C)NC(=O)CCC1CCCCC1.CC(C)NC(=O)c1ccccc1.CCC#Cc1ccc2c(n1)CN(C(C)C)C2=O.CCCCc1ccc2c(n1)CN(C(C)C)C2=O.Cc1ccc(C(=O)NC(C)C)cc1.Cc1ccc2c(c1)C(=O)N(C(C)C)C2.
What is the InChIKey of 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one?
The InChIKey is NJSMNFUMEKOZJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O.C14H16N2O.C12H15NO.C12H23NO.C11H12ClNO.C11H15NO.C11H21NO.C10H12N2O.C10H13NO.C8H17NO/c2*1-4-5-6-11-7-8-12-13(15-11)9-16(10(2)3)14(12)17;1-8(2)13-7-10-5-4-9(3)6-11(10)12(13)14;1-10(2)13-12(14)9-8-11-6-4-3-5-7-11;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-8(2)12-11(13)10-6-4-9(3)5-7-10;1-9(2)12-11(13)8-10-6-4-3-5-7-10;1-7(2)12-6-9-8(10(12)13)4-3-5-11-9;1-8(2)11-10(12)9-6-4-3-5-7-9;1-6(2)5-8(10)9-7(3)4/h7-8,10H,4-6,9H2,1-3H3;7-8,10H,4,9H2,1-3H3;4-6,8H,7H2,1-3H3;10-11H,3-9H2,1-2H3,(H,13,14);3-5,7H,6H2,1-2H3;4-8H,1-3H3,(H,12,13);9-10H,3-8H2,1-2H3,(H,12,13);3-5,7H,6H2,1-2H3;3-8H,1-2H3,(H,11,12);6-7H,5H2,1-4H3,(H,9,10).
What are the key properties of 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one?
2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one has a molecular weight of 1900.09 g/mol, XLogP of 22.37, 22 rotatable bonds, 5 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-but-1-ynyl-6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;2-cyclohexyl-N-propan-2-ylacetamide;3-cyclohexyl-N-propan-2-ylpropanamide;4-methyl-N-propan-2-ylbenzamide;3-methyl-N-propan-2-ylbutanamide;6-methyl-2-propan-2-yl-3H-isoindol-1-one;N-propan-2-ylbenzamide;6-propan-2-yl-7H-pyrrolo[3,4-b]pyridin-5-one is sourced from PubChem (CID 167628030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).