cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide

C107H125Cl3F3N17O8 — CID 167683519

IUPACcis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide
SMILESCC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3cc(F)c4nn(C)c(C(C)C)c4c3)c(C)cn2)C1.CC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3cc(F)c4nn(C)c(C5CC5)c4c3)c(Cl)cn2)C1.CC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3ccc4nn(C)c(C(C)C)c4n3)c(Cl)cn2)C1.CC(C)c1c2cc(-c3cc(NC(=O)[C@H]4CCC[C@@H](CC(=O)C5(C)CC5)C4)ncc3Cl)cc(F)c2nn1C
InChIInChI=1S/C29H34ClFN4O2.C27H33FN4O2.C26H28ClFN4O2.C25H30ClN5O2/c1-16(2)27-21-12-19(13-23(31)26(21)34-35(27)4)20-14-25(32-15-22(20)30)33-28(37)18-7-5-6-17(10-18)11-24(36)29(3)8-9-29;1-15(2)26-22-11-20(12-23(28)25(22)31-32(26)5)21-13-24(29-14-16(21)3)30-27(34)19-8-6-7-18(10-19)9-17(4)33;1-14(33)8-15-4-3-5-17(9-15)26(34)30-23-12-19(21(27)13-29-23)18-10-20-24(22(28)11-18)31-32(2)25(20)16-6-7-16;1-14(2)24-23-21(30-31(24)4)9-8-20(28-23)18-12-22(27-13-19(18)26)29-25(33)17-7-5-6-16(11-17)10-15(3)32/h12-18H,5-11H2,1-4H3,(H,32,33,37);11-15,18-19H,6-10H2,1-5H3,(H,29,30,34);10-13,15-17H,3-9H2,1-2H3,(H,29,30,34);8-9,12-14,16-17H,5-7,10-11H2,1-4H3,(H,27,29,33)/t17-,18+;18-,19-;15-,17-;16-,17-/m1000/s1
InChIKeyVWNVMRAIQZGDKK-LCRZETOOSA-N
MW1940.64 g/mol
LogP24.55
Rot. Bonds25

About cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide

cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide (PubChem CID 167683519) has the molecular formula C107H125Cl3F3N17O8 and a molecular weight of 1940.64 g/mol. Its IUPAC name is cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Namecis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide
PubChem CID167683519
Molecular FormulaC107H125Cl3F3N17O8
Molecular Weight1940.64 g/mol
Exact Mass1937.89
IUPAC Namecis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide
SMILESCC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3cc(F)c4nn(C)c(C(C)C)c4c3)c(C)cn2)C1.CC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3cc(F)c4nn(C)c(C5CC5)c4c3)c(Cl)cn2)C1.CC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3ccc4nn(C)c(C(C)C)c4n3)c(Cl)cn2)C1.CC(C)c1c2cc(-c3cc(NC(=O)[C@H]4CCC[C@@H](CC(=O)C5(C)CC5)C4)ncc3Cl)cc(F)c2nn1C
InChIInChI=1S/C29H34ClFN4O2.C27H33FN4O2.C26H28ClFN4O2.C25H30ClN5O2/c1-16(2)27-21-12-19(13-23(31)26(21)34-35(27)4)20-14-25(32-15-22(20)30)33-28(37)18-7-5-6-17(10-18)11-24(36)29(3)8-9-29;1-15(2)26-22-11-20(12-23(28)25(22)31-32(26)5)21-13-24(29-14-16(21)3)30-27(34)19-8-6-7-18(10-19)9-17(4)33;1-14(33)8-15-4-3-5-17(9-15)26(34)30-23-12-19(21(27)13-29-23)18-10-20-24(22(28)11-18)31-32(2)25(20)16-6-7-16;1-14(2)24-23-21(30-31(24)4)9-8-20(28-23)18-12-22(27-13-19(18)26)29-25(33)17-7-5-6-16(11-17)10-15(3)32/h12-18H,5-11H2,1-4H3,(H,32,33,37);11-15,18-19H,6-10H2,1-5H3,(H,29,30,34);10-13,15-17H,3-9H2,1-2H3,(H,29,30,34);8-9,12-14,16-17H,5-7,10-11H2,1-4H3,(H,27,29,33)/t17-,18+;18-,19-;15-,17-;16-,17-/m1000/s1
InChIKeyVWNVMRAIQZGDKK-LCRZETOOSA-N
XLogP24.55
TPSA320.41 Ų
H-Bond Donors4
H-Bond Acceptors21
Rotatable Bonds25
Heavy Atoms138
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001940.64
LogP ≤ 524.55
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1021

Analyze cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide with MolForge

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Related Compounds

5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]-2-[(4-imidazol-1-ylcyclohexyl)methyl]pyrimidine;5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]-2-[(4-pyrazol-1-ylcyclohexyl)methyl]pyrimidine;N-[4-[[5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]pyrimidin-2-yl]methyl]cyclohexyl]aniline;4-[[5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]pyrimidin-2-yl]methyl]-1-methylcyclohexan-1-amine;8-[[5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]pyrimidin-2-yl]methyl]spiro[4.5]decan-3-one;4-[[4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]pyrimidin-2-yl]methyl]-1-methylcyclohexan-1-amine;4-[[4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]cyclohexan-1-amine
CID 157740783
5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]-2-[(4-imidazol-1-ylcyclohexyl)methyl]pyrimidine;5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]-2-[(4-pyrazol-1-ylcyclohexyl)methyl]pyrimidine;N-[4-[[5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]pyrimidin-2-yl]methyl]cyclohexyl]aniline;4-[[5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]pyrimidin-2-yl]methyl]-1-methylcyclohexan-1-amine;8-[[5-chloro-4-[2-(cyclopropylmethyl)-1-methylpyrrol-3-yl]pyrimidin-2-yl]methyl]spiro[4.5]decan-3-one;4-[[4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]cyclohexan-1-amine
CID 158103083
(2S)-2-(3-chlorophenyl)-2-[2-(4-methylphenyl)ethylamino]-N-[5-(1-methylpyrazol-4-yl)-2-pyridinyl]acetamide;(2R)-2-(3-chlorophenyl)-2-[2-(4-methylphenyl)ethylamino]-N-[5-(1-methylpyrazol-4-yl)-2-pyridinyl]acetamide;(2S)-N-[5-(3,3-difluoropyrrolidin-1-yl)-2-pyridinyl]-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetamide;(2R)-N-[5-(3,3-difluoropyrrolidin-1-yl)-2-pyridinyl]-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetamide;(2S)-2-[2-(4-methylphenyl)ethylamino]-N-[5-(4-methyltriazol-1-yl)-2-pyridinyl]-2-phenylacetamide;(2R)-2-[2-(4-methylphenyl)ethylamino]-N-[5-(4-methyltriazol-1-yl)-2-pyridinyl]-2-phenylacetamide
CID 158377412
cis-(1S,3R)-N-[5-chloro-4-[3-(1,1-difluoro-2-hydroxypropan-2-yl)-7-fluoro-2-methylindazol-5-yl]-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-[7-fluoro-2-methyl-3-(1,1,1-trifluoro-2-hydroxypropan-2-yl)indazol-5-yl]-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-[7-fluoro-2-methyl-3-(1,1,1-trifluoro-2-hydroxypropan-2-yl)indazol-5-yl]-5-methyl-2-pyridinyl]-3-(2-oxobutyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-[7-fluoro-2-methyl-3-(1,1,1-trifluoro-2-hydroxypropan-2-yl)indazol-5-yl]-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide
CID 158875453
N-[6-amino-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]-3-methylbenzamide;N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]-4-methylbenzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide
CID 159809736
1-[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-3-(8-chloroimidazo[1,5-a]pyridin-3-yl)-3-methylbutan-1-one;1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-3-(3,5-dimethyl-2,6-naphthyridin-1-yl)-3-methylbutan-1-one;1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-2-[1-(8-methylimidazo[1,5-a]pyridin-3-yl)cyclobutyl]ethanone;1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-3-methyl-3-(2-methylquinazolin-4-yl)butan-1-one;1-[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-3-methyl-3-(8-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-one;1-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-3-methyl-3-[2-(trifluoromethyl)quinazolin-4-yl]butan-1-one
CID 159856044
5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-[5-[(dimethylamino)methyl]-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-(1,5-dimethylpyrazol-3-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 160147058
6-(5-chloro-3-pyridinyl)-3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazine;1-cyclopropyl-2-[4-[3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-2-fluorophenyl]ethanone;3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-6-(5-fluoro-3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-6-(5-isocyano-3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-6-(5-methyl-3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine;5-[3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-N-methylpyridine-2-carboxamide
CID 160536544
5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-[5-[(dimethylamino)methyl]-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-(1,5-dimethylpyrazol-3-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 161410519
1-[2-(cyclopropylamino)-5-(trifluoromethyl)phenyl]-3-[4-(1-methylpyrazolo[5,4-c]pyridin-4-yl)phenyl]urea;1-(4-ethyl-2-pyridinyl)-3-[2-fluoro-4-(1-methylpyrazolo[5,4-c]pyridin-4-yl)phenyl]urea;2-methyl-N-[2-[[4-(1-methylpyrazolo[5,4-c]pyridin-4-yl)phenyl]carbamoylamino]-4-(trifluoromethyl)phenyl]propanamide;1-[4-(1-methylpyrazolo[5,4-c]pyridin-4-yl)phenyl]-3-(4-methyl-2-pyridinyl)urea
CID 161500938
5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]-2-[(4-imidazol-1-ylcyclohexyl)methyl]pyrimidine;5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]-2-[(4-pyrazol-1-ylcyclohexyl)methyl]pyrimidine;N-[4-[[5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]pyrimidin-2-yl]methyl]cyclohexyl]aniline;4-[[5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]pyrimidin-2-yl]methyl]-1-methylcyclohexan-1-amine;8-[[5-chloro-4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]pyrimidin-2-yl]methyl]spiro[4.5]decan-3-one;4-[[4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]cyclohexan-1-amine
CID 161623521
(1S,5R)-N-[1-(7-chloro-1-methylindazol-3-yl)ethyl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-(1-cyclopropylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[1-(1,7-dimethylindazol-3-yl)ethyl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;bis((1S,5R)-N-[1-(1-methylindazol-3-yl)ethyl]-3-azabicyclo[3.1.0]hexane-6-carboxamide);(1S,5R)-N-[2-[6-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-[7-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 161833717

Frequently Asked Questions

What is the IUPAC name of cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide?
The IUPAC name of cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide (CID 167683519) is cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide.
What is the SMILES notation for cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide?
The canonical SMILES for cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide is CC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3cc(F)c4nn(C)c(C(C)C)c4c3)c(C)cn2)C1.CC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3cc(F)c4nn(C)c(C5CC5)c4c3)c(Cl)cn2)C1.CC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3ccc4nn(C)c(C(C)C)c4n3)c(Cl)cn2)C1.CC(C)c1c2cc(-c3cc(NC(=O)[C@H]4CCC[C@@H](CC(=O)C5(C)CC5)C4)ncc3Cl)cc(F)c2nn1C.
What is the InChIKey of cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide?
The InChIKey is VWNVMRAIQZGDKK-LCRZETOOSA-N. The full InChI is InChI=1S/C29H34ClFN4O2.C27H33FN4O2.C26H28ClFN4O2.C25H30ClN5O2/c1-16(2)27-21-12-19(13-23(31)26(21)34-35(27)4)20-14-25(32-15-22(20)30)33-28(37)18-7-5-6-17(10-18)11-24(36)29(3)8-9-29;1-15(2)26-22-11-20(12-23(28)25(22)31-32(26)5)21-13-24(29-14-16(21)3)30-27(34)19-8-6-7-18(10-19)9-17(4)33;1-14(33)8-15-4-3-5-17(9-15)26(34)30-23-12-19(21(27)13-29-23)18-10-20-24(22(28)11-18)31-32(2)25(20)16-6-7-16;1-14(2)24-23-21(30-31(24)4)9-8-20(28-23)18-12-22(27-13-19(18)26)29-25(33)17-7-5-6-16(11-17)10-15(3)32/h12-18H,5-11H2,1-4H3,(H,32,33,37);11-15,18-19H,6-10H2,1-5H3,(H,29,30,34);10-13,15-17H,3-9H2,1-2H3,(H,29,30,34);8-9,12-14,16-17H,5-7,10-11H2,1-4H3,(H,27,29,33)/t17-,18+;18-,19-;15-,17-;16-,17-/m1000/s1.
What are the key properties of cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide?
cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide has a molecular weight of 1940.64 g/mol, XLogP of 24.55, 25 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,3R)-N-[5-chloro-4-(3-cyclopropyl-7-fluoro-2-methylindazol-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]-3-[2-(1-methylcyclopropyl)-2-oxoethyl]cyclohexane-1-carboxamide;cis-(1S,3R)-N-[5-chloro-4-(2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide;cis-(1S,3R)-N-[4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-5-methyl-2-pyridinyl]-3-(2-oxopropyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 167683519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).