6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one

C118H167N25O8 — CID 158582268

IUPAC6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one
SMILESC/C=C(/C)c1cnc2[nH]c(=O)n(C(CC)CC)c2c1.CCC(C)c1cnc2[nH]c(=O)n(C(CC)CC)c2c1.CCC(CC)n1c(=O)[nH]c2ncc(C3=CCCC3)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C3CCCC3)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C=C(C)C)cc21.CCC(CC)n1c(=O)[nH]c2ncc(CC(C)C)cc21.CCC(CC)n1c(=O)[nH]c2nccc(C#N)c21.CCCc1cnc2[nH]c(=O)n(C(CC)CC)c2c1
InChIInChI=1S/C16H23N3O.C16H21N3O.C15H23N3O.C15H21N3O.C15H23N3O.C15H21N3O.C14H21N3O.C12H14N4O/c2*1-3-13(4-2)19-14-9-12(11-7-5-6-8-11)10-17-15(14)18-16(19)20;2*1-5-12(6-2)18-13-8-11(7-10(3)4)9-16-14(13)17-15(18)19;2*1-5-10(4)11-8-13-14(16-9-11)17-15(19)18(13)12(6-2)7-3;1-4-7-10-8-12-13(15-9-10)16-14(18)17(12)11(5-2)6-3;1-3-9(4-2)16-10-8(7-13)5-6-14-11(10)15-12(16)17/h9-11,13H,3-8H2,1-2H3,(H,17,18,20);7,9-10,13H,3-6,8H2,1-2H3,(H,17,18,20);8-10,12H,5-7H2,1-4H3,(H,16,17,19);7-9,12H,5-6H2,1-4H3,(H,16,17,19);8-10,12H,5-7H2,1-4H3,(H,16,17,19);5,8-9,12H,6-7H2,1-4H3,(H,16,17,19);8-9,11H,4-7H2,1-3H3,(H,15,16,18);5-6,9H,3-4H2,1-2H3,(H,14,15,17)/b;;;;;10-5-;;
InChIKeyHTJZCIWSDHEKBL-JNPWHATMSA-N
MW2063.80 g/mol
LogP26.29
Rot. Bonds34

About 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one

6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one (PubChem CID 158582268) has the molecular formula C118H167N25O8 and a molecular weight of 2063.80 g/mol. Its IUPAC name is 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one
PubChem CID158582268
Molecular FormulaC118H167N25O8
Molecular Weight2063.80 g/mol
Exact Mass2062.34
IUPAC Name6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one
SMILESC/C=C(/C)c1cnc2[nH]c(=O)n(C(CC)CC)c2c1.CCC(C)c1cnc2[nH]c(=O)n(C(CC)CC)c2c1.CCC(CC)n1c(=O)[nH]c2ncc(C3=CCCC3)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C3CCCC3)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C=C(C)C)cc21.CCC(CC)n1c(=O)[nH]c2ncc(CC(C)C)cc21.CCC(CC)n1c(=O)[nH]c2nccc(C#N)c21.CCCc1cnc2[nH]c(=O)n(C(CC)CC)c2c1
InChIInChI=1S/C16H23N3O.C16H21N3O.C15H23N3O.C15H21N3O.C15H23N3O.C15H21N3O.C14H21N3O.C12H14N4O/c2*1-3-13(4-2)19-14-9-12(11-7-5-6-8-11)10-17-15(14)18-16(19)20;2*1-5-12(6-2)18-13-8-11(7-10(3)4)9-16-14(13)17-15(18)19;2*1-5-10(4)11-8-13-14(16-9-11)17-15(19)18(13)12(6-2)7-3;1-4-7-10-8-12-13(15-9-10)16-14(18)17(12)11(5-2)6-3;1-3-9(4-2)16-10-8(7-13)5-6-14-11(10)15-12(16)17/h9-11,13H,3-8H2,1-2H3,(H,17,18,20);7,9-10,13H,3-6,8H2,1-2H3,(H,17,18,20);8-10,12H,5-7H2,1-4H3,(H,16,17,19);7-9,12H,5-6H2,1-4H3,(H,16,17,19);8-10,12H,5-7H2,1-4H3,(H,16,17,19);5,8-9,12H,6-7H2,1-4H3,(H,16,17,19);8-9,11H,4-7H2,1-3H3,(H,15,16,18);5-6,9H,3-4H2,1-2H3,(H,14,15,17)/b;;;;;10-5-;;
InChIKeyHTJZCIWSDHEKBL-JNPWHATMSA-N
XLogP26.29
TPSA429.23 Ų
H-Bond Donors8
H-Bond Acceptors25
Rotatable Bonds34
Heavy Atoms151
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002063.80
LogP ≤ 526.29
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1025

Analyze 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one with MolForge

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Related Compounds

N-[(3S,6R)-7-amino-3-(2,3-difluorophenyl)-3,4,5,6-tetrahydro-2H-azepin-6-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;N-[(3R,6S)-6-(2,3-difluorophenyl)-1-ethyl-2-iminoazepan-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;N-[(3R,6S)-6-(2,3-difluorophenyl)-2-methyliminoazepan-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;N-[(3R,6S)-6-(2,3-difluorophenyl)-2-methylimino-1-(2,2,2-trifluoroethyl)azepan-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;N-[(3S,6R)-3-(2,3-difluorophenyl)-7-(2,2,2-trifluoroethylamino)-3,4,5,6-tetrahydro-2H-azepin-6-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
CID 157669974
N-[(6S,9R)-6-(2,3-difluorophenyl)-3-ethyl-3,5,6,7,8,9-hexahydro-2H-imidazo[1,2-a]azepin-9-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;N-[(3R,6S)-6-(2,3-difluorophenyl)-1-ethyl-2-methyliminoazepan-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;N-[(3R,6S)-6-(2,3-difluorophenyl)-2-imino-1-(2,2,2-trifluoroethyl)azepan-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;N-[(6S,9R)-6-(2,3-difluorophenyl)-3-(2,2,2-trifluoroethyl)-3,5,6,7,8,9-hexahydro-2H-imidazo[1,2-a]azepin-9-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
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(3S,6R)-N-cyclopentyl-3-(2,3-difluorophenyl)-6-[[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carbonyl]amino]azepane-1-carboxamide;(3S,6R)-3-(2,3-difluorophenyl)-N-ethyl-6-[[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carbonyl]amino]azepane-1-carboxamide;(3S,6R)-3-(2,3-difluorophenyl)-N-methyl-6-[[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carbonyl]amino]azepane-1-carboxamide;(3S,6R)-3-(2,3-difluorophenyl)-6-[[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carbonyl]amino]-N-propan-2-ylazepane-1-carboxamide;(3S,6R)-3-(2,3-difluorophenyl)-6-[[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carbonyl]amino]-N-(2,2,2-trifluoroethyl)azepane-1-carboxamide;N-[(3R,6S)-6-(2,3-difluorophenyl)-1-(pyrrolidine-1-carbonyl)azepan-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
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6-amino-9-[[5-(3-cyclobutylpropyl)pyrazin-2-yl]methyl]-2-methyl-7H-purin-8-one;6-amino-9-[[5-(2-cyclopropylethyl)pyrazin-2-yl]methyl]-2-methyl-7H-purin-8-one;6-amino-2-methyl-9-[[5-(3-methylbutyl)pyrazin-2-yl]methyl]-7H-purin-8-one;6-amino-2-methyl-9-[(5-pentylpyrazin-2-yl)methyl]-7H-purin-8-one;6-amino-2-methyl-9-[[5-(3-phenylpropyl)pyrazin-2-yl]methyl]-7H-purin-8-one;6-amino-2-methyl-9-[[5-(3-pyridin-4-ylpropyl)pyrazin-2-yl]methyl]-7H-purin-8-one
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2-[2-amino-4-(2-methyl-4-pyridinyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-chloro-4-(2-methyl-4-pyridinyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-cyano-4-(2-methyl-4-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-(2-methyl-4-pyridinyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide
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4-[4-tert-butyl-6-[4-[4-tert-butyl-6-(2-cyano-4-isocyanobenzene-6-id-1-yl)-2-pyridinyl]butyl]-2-pyridinyl]-3-isocyanobenzene-5-ide-1-carbonitrile;4-[6-[4-[6-(2-cyano-4-isocyanobenzene-6-id-1-yl)-4-cyclohexyl-2-pyridinyl]butyl]-4-cyclohexyl-2-pyridinyl]-3-isocyanobenzene-5-ide-1-carbonitrile;4-[6-[4-[6-(2-cyano-4-isocyanobenzene-6-id-1-yl)-4-propyl-2-pyridinyl]butyl]-4-propyl-2-pyridinyl]-3-isocyanobenzene-5-ide-1-carbonitrile;tris(iridium);bis(1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide);1,5,6-trimethyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide
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Ethane;5,6,7-trimethyl-5a,9a-dihydropyrido[3,2-b]indole;5,6,7-trimethyl-5a,9a-dihydropyrido[4,3-b]indole;3,4,5-trimethyl-4a,9b-dihydropyrido[3,2-b]indole;7,8,9-trimethyl-4b,8a-dihydropyrido[2,3-b]indole;7,8,9-trimethyl-4b,8a-dihydropyrido[3,4-b]indole
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bis(3-(1-tert-butylpiperidin-4-yl)-1H-benzimidazol-2-one);bis(3-(1-tert-butylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-2-one);bis(1-(1-tert-butylpiperidin-4-yl)-3H-imidazo[4,5-c]pyridin-2-one);bis(3-(1-tert-butylpiperidin-4-yl)-1H-imidazo[4,5-c]pyridin-2-one)
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1,3-dimethyl-7-propan-2-ylimidazo[4,5-b]pyridin-2-one;methane;1-methyl-7-propan-2-yl-3H-imidazo[4,5-b]pyridin-2-one;3-methyl-7-propan-2-yl-1H-imidazo[4,5-b]pyridin-2-one;7-propan-2-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
CID 158122543

Frequently Asked Questions

What is the IUPAC name of 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one (CID 158582268) is 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one is C/C=C(/C)c1cnc2[nH]c(=O)n(C(CC)CC)c2c1.CCC(C)c1cnc2[nH]c(=O)n(C(CC)CC)c2c1.CCC(CC)n1c(=O)[nH]c2ncc(C3=CCCC3)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C3CCCC3)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C=C(C)C)cc21.CCC(CC)n1c(=O)[nH]c2ncc(CC(C)C)cc21.CCC(CC)n1c(=O)[nH]c2nccc(C#N)c21.CCCc1cnc2[nH]c(=O)n(C(CC)CC)c2c1.
What is the InChIKey of 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is HTJZCIWSDHEKBL-JNPWHATMSA-N. The full InChI is InChI=1S/C16H23N3O.C16H21N3O.C15H23N3O.C15H21N3O.C15H23N3O.C15H21N3O.C14H21N3O.C12H14N4O/c2*1-3-13(4-2)19-14-9-12(11-7-5-6-8-11)10-17-15(14)18-16(19)20;2*1-5-12(6-2)18-13-8-11(7-10(3)4)9-16-14(13)17-15(18)19;2*1-5-10(4)11-8-13-14(16-9-11)17-15(19)18(13)12(6-2)7-3;1-4-7-10-8-12-13(15-9-10)16-14(18)17(12)11(5-2)6-3;1-3-9(4-2)16-10-8(7-13)5-6-14-11(10)15-12(16)17/h9-11,13H,3-8H2,1-2H3,(H,17,18,20);7,9-10,13H,3-6,8H2,1-2H3,(H,17,18,20);8-10,12H,5-7H2,1-4H3,(H,16,17,19);7-9,12H,5-6H2,1-4H3,(H,16,17,19);8-10,12H,5-7H2,1-4H3,(H,16,17,19);5,8-9,12H,6-7H2,1-4H3,(H,16,17,19);8-9,11H,4-7H2,1-3H3,(H,15,16,18);5-6,9H,3-4H2,1-2H3,(H,14,15,17)/b;;;;;10-5-;;.
What are the key properties of 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one?
6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 2063.80 g/mol, XLogP of 26.29, 34 rotatable bonds, 8 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 6-butan-2-yl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-[(Z)-but-2-en-2-yl]-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(cyclopenten-1-yl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-cyclopentyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylprop-1-enyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-(2-methylpropyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridine-7-carbonitrile;1-pentan-3-yl-6-propyl-3H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 158582268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).