5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone

C131H115Cl3F4N14O13 — CID 160904928

IUPAC5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone
SMILESCC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccn(-c2ccccc2)n1.COc1ccc2[nH]c(C(=O)N[C@H](C)c3ccccc3)cc2c1.COc1ccc2c(c1)CC(C(=O)NC1(c3ccccc3)COC1)=C2.C[C@@H](NC(=O)c1cc2cc(Cl)cc(F)c2[nH]1)c1ccccc1.O=C(CC1(c2ccccc2)COC1)c1cc2cc(C(F)(F)F)ccc2[nH]1.O=C(CC1(c2ccccc2)COC1)c1cc2cc(Cl)cnc2[nH]1.O=C(NC1(c2ccccc2)CC1)c1cc2ccc(O)cc2[nH]1
InChIInChI=1S/C20H17ClN4O.C20H16F3NO2.C20H19NO3.C18H15ClN2O2.C18H16N2O2.C18H18N2O2.C17H14ClFN2O/c1-13(17-9-10-25(24-17)16-5-3-2-4-6-16)22-20(26)19-12-14-11-15(21)7-8-18(14)23-19;21-20(22,23)15-6-7-16-13(8-15)9-17(24-16)18(25)10-19(11-26-12-19)14-4-2-1-3-5-14;1-23-18-8-7-14-9-16(10-15(14)11-18)19(22)21-20(12-24-13-20)17-5-3-2-4-6-17;19-14-6-12-7-15(21-17(12)20-9-14)16(22)8-18(10-23-11-18)13-4-2-1-3-5-13;21-14-7-6-12-10-16(19-15(12)11-14)17(22)20-18(8-9-18)13-4-2-1-3-5-13;1-12(13-6-4-3-5-7-13)19-18(21)17-11-14-10-15(22-2)8-9-16(14)20-17;1-10(11-5-3-2-4-6-11)20-17(22)15-8-12-7-13(18)9-14(19)16(12)21-15/h2-13,23H,1H3,(H,22,26);1-9,24H,10-12H2;2-9,11H,10,12-13H2,1H3,(H,21,22);1-7,9H,8,10-11H2,(H,20,21);1-7,10-11,19,21H,8-9H2,(H,20,22);3-12,20H,1-2H3,(H,19,21);2-10,21H,1H3,(H,20,22)/t;;;;;12-;10-/m.....11/s1
InChIKeySPZYEWHFIGJBJE-MTMXEPSOSA-N
MW2275.80 g/mol
LogP27.07
Rot. Bonds26

About 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone

5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone (PubChem CID 160904928) has the molecular formula C131H115Cl3F4N14O13 and a molecular weight of 2275.80 g/mol. Its IUPAC name is 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone.

Molecular Properties

Compound Name5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone
PubChem CID160904928
Molecular FormulaC131H115Cl3F4N14O13
Molecular Weight2275.80 g/mol
Exact Mass2272.78
IUPAC Name5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone
SMILESCC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccn(-c2ccccc2)n1.COc1ccc2[nH]c(C(=O)N[C@H](C)c3ccccc3)cc2c1.COc1ccc2c(c1)CC(C(=O)NC1(c3ccccc3)COC1)=C2.C[C@@H](NC(=O)c1cc2cc(Cl)cc(F)c2[nH]1)c1ccccc1.O=C(CC1(c2ccccc2)COC1)c1cc2cc(C(F)(F)F)ccc2[nH]1.O=C(CC1(c2ccccc2)COC1)c1cc2cc(Cl)cnc2[nH]1.O=C(NC1(c2ccccc2)CC1)c1cc2ccc(O)cc2[nH]1
InChIInChI=1S/C20H17ClN4O.C20H16F3NO2.C20H19NO3.C18H15ClN2O2.C18H16N2O2.C18H18N2O2.C17H14ClFN2O/c1-13(17-9-10-25(24-17)16-5-3-2-4-6-16)22-20(26)19-12-14-11-15(21)7-8-18(14)23-19;21-20(22,23)15-6-7-16-13(8-15)9-17(24-16)18(25)10-19(11-26-12-19)14-4-2-1-3-5-14;1-23-18-8-7-14-9-16(10-15(14)11-18)19(22)21-20(12-24-13-20)17-5-3-2-4-6-17;19-14-6-12-7-15(21-17(12)20-9-14)16(22)8-18(10-23-11-18)13-4-2-1-3-5-13;21-14-7-6-12-10-16(19-15(12)11-14)17(22)20-18(8-9-18)13-4-2-1-3-5-13;1-12(13-6-4-3-5-7-13)19-18(21)17-11-14-10-15(22-2)8-9-16(14)20-17;1-10(11-5-3-2-4-6-11)20-17(22)15-8-12-7-13(18)9-14(19)16(12)21-15/h2-13,23H,1H3,(H,22,26);1-9,24H,10-12H2;2-9,11H,10,12-13H2,1H3,(H,21,22);1-7,9H,8,10-11H2,(H,20,21);1-7,10-11,19,21H,8-9H2,(H,20,22);3-12,20H,1-2H3,(H,19,21);2-10,21H,1H3,(H,20,22)/t;;;;;12-;10-/m.....11/s1
InChIKeySPZYEWHFIGJBJE-MTMXEPSOSA-N
XLogP27.07
TPSA371.47 Ų
H-Bond Donors12
H-Bond Acceptors16
Rotatable Bonds26
Heavy Atoms165
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002275.80
LogP ≤ 527.07
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1016

Analyze 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone with MolForge

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Related Compounds

5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone
CID 157319466
5-chloro-1-propan-2-ylindole;2-(1,1-difluoroethyl)-1-propan-2-ylindole;5,6-difluoro-1-propan-2-ylindole;5,6-dimethyl-2-propan-2-ylindazole;[1,3-di(propan-2-yl)pyrazol-5-yl]-(3-methoxyazetidin-1-yl)methanone;1-fluoro-4-propan-2-ylbenzene;methane;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;1-methoxy-3-propan-2-ylbenzene;6-methyl-3-propan-2-yl-1H-indol-5-ol;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;2-methyl-4-propan-2-yl-[1,2,4]triazolo[1,5-a]benzimidazole;1-methyl-3-propan-2-yl-5-(trifluoromethyl)indole;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;1-propan-2-ylindazol-6-ol;1-propan-2-yl-6-(trifluoromethyl)indole
CID 157577967
5-chloro-1-propan-2-ylindole;2-(1,1-difluoroethyl)-1-propan-2-ylindole;5,6-difluoro-1-propan-2-ylindole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-yl-3H-indol-1-ium-5-ol;[1,3-di(propan-2-yl)pyrazol-5-yl]-(3-methoxyazetidin-1-yl)methanone;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;1-methoxy-3-propan-2-ylbenzene;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;2-methyl-4-propan-2-yl-[1,2,4]triazolo[1,5-a]benzimidazole;1-methyl-3-propan-2-yl-5-(trifluoromethyl)indole;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;1-propan-2-ylindazol-6-ol;1-propan-2-yl-6-(trifluoromethyl)indole
CID 157662877
5-chloro-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;1-(6-methoxy-1H-indol-2-yl)-2-(1-phenylcyclopropyl)ethanone;6-methoxy-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;6-methoxy-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide
CID 157894412
5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-methoxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;6-methoxy-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone
CID 158950210
5-chloro-1-propan-2-ylindole;5,6-difluoro-1-propan-2-ylindole;[1,3-di(propan-2-yl)pyrazol-5-yl]-(3-methoxyazetidin-1-yl)methanone;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-propan-2-ylbenzene;6-methyl-3-propan-2-yl-1H-indol-5-ol;2-methyl-4-propan-2-yl-[1,2,4]triazolo[1,5-a]benzimidazole;1-propan-2-ylindazol-6-ol;1-propan-2-yl-2-(trifluoromethyl)indole;1-propan-2-yl-6-(trifluoromethyl)indole;3-propan-2-yl-5-(trifluoromethyl)-1H-indole
CID 159592086
6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole
CID 159820368
5-chloro-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;5-ethyl-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-ethyl-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide
CID 159974727
5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone
CID 160288524
N-[1-(1-acetylpiperidin-4-yl)cyclopropyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylsulfonylpiperidin-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methoxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide
CID 160885442
N-[1-(1-acetylpiperidin-4-yl)cyclopropyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylsulfonylpiperidin-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;(3S)-1-(6-methoxy-1H-indol-2-yl)-3-phenylbutan-1-one;1-(6-methoxy-1H-indol-2-yl)-2-(1-phenylcyclopropyl)ethanone;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethyl)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide
CID 161427646
5-chloro-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methoxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;6-methoxy-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone
CID 161782381

Frequently Asked Questions

What is the IUPAC name of 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone?
The IUPAC name of 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone (CID 160904928) is 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone.
What is the SMILES notation for 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone?
The canonical SMILES for 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone is CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccn(-c2ccccc2)n1.COc1ccc2[nH]c(C(=O)N[C@H](C)c3ccccc3)cc2c1.COc1ccc2c(c1)CC(C(=O)NC1(c3ccccc3)COC1)=C2.C[C@@H](NC(=O)c1cc2cc(Cl)cc(F)c2[nH]1)c1ccccc1.O=C(CC1(c2ccccc2)COC1)c1cc2cc(C(F)(F)F)ccc2[nH]1.O=C(CC1(c2ccccc2)COC1)c1cc2cc(Cl)cnc2[nH]1.O=C(NC1(c2ccccc2)CC1)c1cc2ccc(O)cc2[nH]1.
What is the InChIKey of 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone?
The InChIKey is SPZYEWHFIGJBJE-MTMXEPSOSA-N. The full InChI is InChI=1S/C20H17ClN4O.C20H16F3NO2.C20H19NO3.C18H15ClN2O2.C18H16N2O2.C18H18N2O2.C17H14ClFN2O/c1-13(17-9-10-25(24-17)16-5-3-2-4-6-16)22-20(26)19-12-14-11-15(21)7-8-18(14)23-19;21-20(22,23)15-6-7-16-13(8-15)9-17(24-16)18(25)10-19(11-26-12-19)14-4-2-1-3-5-14;1-23-18-8-7-14-9-16(10-15(14)11-18)19(22)21-20(12-24-13-20)17-5-3-2-4-6-17;19-14-6-12-7-15(21-17(12)20-9-14)16(22)8-18(10-23-11-18)13-4-2-1-3-5-13;21-14-7-6-12-10-16(19-15(12)11-14)17(22)20-18(8-9-18)13-4-2-1-3-5-13;1-12(13-6-4-3-5-7-13)19-18(21)17-11-14-10-15(22-2)8-9-16(14)20-17;1-10(11-5-3-2-4-6-11)20-17(22)15-8-12-7-13(18)9-14(19)16(12)21-15/h2-13,23H,1H3,(H,22,26);1-9,24H,10-12H2;2-9,11H,10,12-13H2,1H3,(H,21,22);1-7,9H,8,10-11H2,(H,20,21);1-7,10-11,19,21H,8-9H2,(H,20,22);3-12,20H,1-2H3,(H,19,21);2-10,21H,1H3,(H,20,22)/t;;;;;12-;10-/m.....11/s1.
What are the key properties of 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone?
5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone has a molecular weight of 2275.80 g/mol, XLogP of 27.07, 26 rotatable bonds, 12 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone is sourced from PubChem (CID 160904928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).