3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide

C117H145F3N24O8 — CID 160750801

IUPAC3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide
SMILESC=C(Nc1nc2cc(C)cnc2n1C1CCC1)C(C)(C)COC(C)(C)C.Cc1ccc2nc(NC(=O)CC3CC(F)(F)C3(C)F)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)CCc3ccco3)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)C[C@@H](C)c3ccccc3)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)C[C@H](C)c3ccccc3)n(C3CCC3)c2n1.Cc1cnc2c(c1)nc(NC(=O)CCC1CCCO1)n2C1CCC1
InChIInChI=1S/2C21H24N4O.C21H32N4O.C18H21F3N4O.C18H20N4O2.C18H24N4O2/c2*1-14(16-7-4-3-5-8-16)13-19(26)24-21-23-18-12-11-15(2)22-20(18)25(21)17-9-6-10-17;1-14-11-17-18(22-12-14)25(16-9-8-10-16)19(24-17)23-15(2)21(6,7)13-26-20(3,4)5;1-10-6-7-13-15(22-10)25(12-4-3-5-12)16(23-13)24-14(26)8-11-9-18(20,21)17(11,2)19;1-12-7-9-15-17(19-12)22(13-4-2-5-13)18(20-15)21-16(23)10-8-14-6-3-11-24-14;1-12-10-15-17(19-11-12)22(13-4-2-5-13)18(20-15)21-16(23)8-7-14-6-3-9-24-14/h2*3-5,7-8,11-12,14,17H,6,9-10,13H2,1-2H3,(H,23,24,26);11-12,16H,2,8-10,13H2,1,3-7H3,(H,23,24);6-7,11-12H,3-5,8-9H2,1-2H3,(H,23,24,26);3,6-7,9,11,13H,2,4-5,8,10H2,1H3,(H,20,21,23);10-11,13-14H,2-9H2,1H3,(H,20,21,23)/t2*14-;;;;/m10..../s1
InChIKeyRWUGEVWYPOPYEI-IKBGVWIDSA-N
MW2072.60 g/mol
LogP25.59
Rot. Bonds30

About 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide

3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide (PubChem CID 160750801) has the molecular formula C117H145F3N24O8 and a molecular weight of 2072.60 g/mol. Its IUPAC name is 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide.

Molecular Properties

Compound Name3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide
PubChem CID160750801
Molecular FormulaC117H145F3N24O8
Molecular Weight2072.60 g/mol
Exact Mass2071.16
IUPAC Name3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide
SMILESC=C(Nc1nc2cc(C)cnc2n1C1CCC1)C(C)(C)COC(C)(C)C.Cc1ccc2nc(NC(=O)CC3CC(F)(F)C3(C)F)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)CCc3ccco3)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)C[C@@H](C)c3ccccc3)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)C[C@H](C)c3ccccc3)n(C3CCC3)c2n1.Cc1cnc2c(c1)nc(NC(=O)CCC1CCCO1)n2C1CCC1
InChIInChI=1S/2C21H24N4O.C21H32N4O.C18H21F3N4O.C18H20N4O2.C18H24N4O2/c2*1-14(16-7-4-3-5-8-16)13-19(26)24-21-23-18-12-11-15(2)22-20(18)25(21)17-9-6-10-17;1-14-11-17-18(22-12-14)25(16-9-8-10-16)19(24-17)23-15(2)21(6,7)13-26-20(3,4)5;1-10-6-7-13-15(22-10)25(12-4-3-5-12)16(23-13)24-14(26)8-11-9-18(20,21)17(11,2)19;1-12-7-9-15-17(19-12)22(13-4-2-5-13)18(20-15)21-16(23)10-8-14-6-3-11-24-14;1-12-10-15-17(19-11-12)22(13-4-2-5-13)18(20-15)21-16(23)8-7-14-6-3-9-24-14/h2*3-5,7-8,11-12,14,17H,6,9-10,13H2,1-2H3,(H,23,24,26);11-12,16H,2,8-10,13H2,1,3-7H3,(H,23,24);6-7,11-12H,3-5,8-9H2,1-2H3,(H,23,24,26);3,6-7,9,11,13H,2,4-5,8,10H2,1H3,(H,20,21,23);10-11,13-14H,2-9H2,1H3,(H,20,21,23)/t2*14-;;;;/m10..../s1
InChIKeyRWUGEVWYPOPYEI-IKBGVWIDSA-N
XLogP25.59
TPSA373.39 Ų
H-Bond Donors6
H-Bond Acceptors27
Rotatable Bonds30
Heavy Atoms152
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002072.60
LogP ≤ 525.59
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1027

Analyze 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide with MolForge

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Related Compounds

4-[8-amino-3-[(8aS)-3-oxo-2,5,6,7,8,8a-hexahydro-1H-indolizin-6-yl]imidazo[1,5-a]pyrazin-1-yl]-3-ethoxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide;4-[8-amino-3-[(8aS)-3-oxo-2,5,6,7,8,8a-hexahydro-1H-indolizin-6-yl]imidazo[1,5-a]pyrazin-1-yl]-3-methoxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide;1,2-dimethylcyclobutane
CID 145113953
[(3R)-3-[[2-[6-[(3R)-3-aminopiperidine-1-carbonyl]-3-(5-oxaspiro[3.4]octan-2-ylmethyl)imidazo[4,5-b]pyridin-2-yl]-1-ethylpyrrolo[2,3-b]pyridin-6-yl]oxymethylamino]piperidin-1-yl]-[2-[1-(cyclopropylmethyl)-6-(difluoromethoxy)pyrrolo[2,3-b]pyridin-2-yl]-3-methylimidazo[4,5-b]pyridin-6-yl]methanone
CID 155131908
N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;3,3-dimethyl-N-[5-methyl-3-[4-(2,2,2-trifluoroethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide
CID 157177295
8-(1-tert-butylbenzimidazol-2-yl)-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(1-ethylbenzimidazol-2-yl)-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);8-(1-methylbenzimidazol-2-yl)-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(1-propan-2-ylbenzimidazol-2-yl)-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]germane)
CID 158218978
N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-methylpropanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-phenoxyacetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-phenylpropanamide;N-[3-cyclobutyl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-3-cyclopentylpropanamide
CID 159394309
3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide
CID 159836034
(3S)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-(4-methylphenyl)butanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;(3S)-3-hydroxy-N-[5-methyl-3-(1-methylcyclobutyl)imidazo[4,5-b]pyridin-2-yl]-3-(4-methylphenyl)butanamide;bis(3-hydroxy-3-methyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide)
CID 160276139
(3S)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-(4-methylphenyl)butanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;3-ethyl-3-hydroxy-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]pentanamide;(3S)-3-hydroxy-N-[5-methyl-3-(1-methylcyclobutyl)imidazo[4,5-b]pyridin-2-yl]-3-(4-methylphenyl)butanamide;bis(3-hydroxy-3-methyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide)
CID 160308799
CID 160341900
CID 160341900
N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentyloxypropanamide;5-chloro-3-cyclobutyl-7-methyl-N-[4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-[(2-methylpropan-2-yl)oxy]propanamide;N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-[(2-methylpropan-2-yl)oxy]propanamide;N-[5-cyclopropyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide;3-[(2-methylpropan-2-yl)oxy]-N-[5-propan-2-yloxy-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]propanamide
CID 160417850
3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole
CID 160590151
5-(3-Benzyl-2-methylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one;5-[3-(cyclobutyloxymethyl)imidazo[1,2-a]pyridin-6-yl]-1,3-dimethylpyridin-2-one;5-[3-(cyclopentylmethylamino)imidazo[1,2-a]pyridin-6-yl]-1,3-dimethylpyridin-2-one;5-[3-[(3,3-difluoropiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]-1,3-dimethylpyridin-2-one;1,3-dimethyl-5-[3-(1,4-oxazepan-4-ylmethyl)imidazo[1,2-a]pyridin-6-yl]pyridin-2-one;1,3-dimethyl-5-[3-[(2-oxopiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]pyridin-2-one;1,3-dimethyl-5-(3-phenoxyimidazo[1,2-a]pyridin-6-yl)pyridin-2-one
CID 161193042

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide?
The IUPAC name of 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide (CID 160750801) is 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide.
What is the SMILES notation for 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide?
The canonical SMILES for 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide is C=C(Nc1nc2cc(C)cnc2n1C1CCC1)C(C)(C)COC(C)(C)C.Cc1ccc2nc(NC(=O)CC3CC(F)(F)C3(C)F)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)CCc3ccco3)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)C[C@@H](C)c3ccccc3)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)C[C@H](C)c3ccccc3)n(C3CCC3)c2n1.Cc1cnc2c(c1)nc(NC(=O)CCC1CCCO1)n2C1CCC1.
What is the InChIKey of 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide?
The InChIKey is RWUGEVWYPOPYEI-IKBGVWIDSA-N. The full InChI is InChI=1S/2C21H24N4O.C21H32N4O.C18H21F3N4O.C18H20N4O2.C18H24N4O2/c2*1-14(16-7-4-3-5-8-16)13-19(26)24-21-23-18-12-11-15(2)22-20(18)25(21)17-9-6-10-17;1-14-11-17-18(22-12-14)25(16-9-8-10-16)19(24-17)23-15(2)21(6,7)13-26-20(3,4)5;1-10-6-7-13-15(22-10)25(12-4-3-5-12)16(23-13)24-14(26)8-11-9-18(20,21)17(11,2)19;1-12-7-9-15-17(19-12)22(13-4-2-5-13)18(20-15)21-16(23)10-8-14-6-3-11-24-14;1-12-10-15-17(19-11-12)22(13-4-2-5-13)18(20-15)21-16(23)8-7-14-6-3-9-24-14/h2*3-5,7-8,11-12,14,17H,6,9-10,13H2,1-2H3,(H,23,24,26);11-12,16H,2,8-10,13H2,1,3-7H3,(H,23,24);6-7,11-12H,3-5,8-9H2,1-2H3,(H,23,24,26);3,6-7,9,11,13H,2,4-5,8,10H2,1H3,(H,20,21,23);10-11,13-14H,2-9H2,1H3,(H,20,21,23)/t2*14-;;;;/m10..../s1.
What are the key properties of 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide?
3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide has a molecular weight of 2072.60 g/mol, XLogP of 25.59, 30 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide is sourced from PubChem (CID 160750801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).