6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide

C138H125F18N25O14S6 — CID 157476294

About 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide

6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide (PubChem CID 157476294) has the molecular formula C138H125F18N25O14S6 and a molecular weight of 2892.04 g/mol. Its IUPAC name is 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide.

Molecular Properties

• Compound Name: 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide
• PubChem CID: 157476294
• Molecular Formula: C138H125F18N25O14S6
• Molecular Weight: 2892.04 g/mol
• Exact Mass: 2889.79
• IUPAC Name: 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide
• SMILES: CC(C)NS(=O)(=O)c1ccc(-c2c(C#N)c3ccc(C(F)F)cc3n2C2CCC2)nc1.CCc1ccc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn3)n(C3CCC3)c2c1.COc1ccc(-n2c(-c3ccc(S(=O)(=O)NC(CF)CF)cn3)c(C#N)c3cc(F)ccc32)cc1.COc1ccc(-n2c(-c3ncc(S(=O)(=O)NC(CF)CF)cn3)c(C#N)c3cc(F)ccc32)cc1.C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3ccc(C(F)F)cc3n2C2CCC2)nc1)C(F)(F)F.C[C@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3ccc(C(F)F)cc3n2C2CCC2)nc1)C1CC1
• InChI: InChI=1S/C24H19F3N4O3S.C24H24F2N4O2S.C23H18F3N5O3S.C23H23F3N4O2S.C22H19F5N4O2S.C22H22F2N4O2S/c1-34-18-5-3-17(4-6-18)31-23-9-2-15(27)10-20(23)21(13-28)24(31)22-8-7-19(14-29-22)35(32,33)30-16(11-25)12-26;1-14(15-5-6-15)29-33(31,32)18-8-10-21(28-13-18)23-20(12-27)19-9-7-16(24(25)26)11-22(19)30(23)17-3-2-4-17;1-34-17-5-3-16(4-6-17)31-21-7-2-14(26)8-19(21)20(11-27)22(31)23-28-12-18(13-29-23)35(32,33)30-15(9-24)10-25;1-3-15-7-9-18-19(12-27)22(30(21(18)11-15)16-5-4-6-16)20-10-8-17(13-28-20)33(31,32)29-14(2)23(24,25)26;1-12(22(25,26)27)30-34(32,33)15-6-8-18(29-11-15)20-17(10-28)16-7-5-13(21(23)24)9-19(16)31(20)14-3-2-4-14;1-13(2)27-31(29,30)16-7-9-19(26-12-16)21-18(11-25)17-8-6-14(22(23)24)10-20(17)28(21)15-4-3-5-15/h2-10,14,16,30H,11-12H2,1H3;7-11,13-15,17,24,29H,2-6H2,1H3;2-8,12-13,15,30H,9-10H2,1H3;7-11,13-14,16,29H,3-6H2,1-2H3;5-9,11-12,14,21,30H,2-4H2,1H3;6-10,12-13,15,22,27H,3-5H2,1-2H3/t;14-;;14-;12-;/m.0.01./s1
• InChIKey: BVPZPCROZQKJIX-PPHRCMDCSA-N
• XLogP: 28.79
• TPSA: 558.03 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 33
• Rotatable Bonds: 41
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2892.04
LogP ≤ 5	28.79
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide?

The IUPAC name of 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide (CID 157476294) is 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide.

What is the SMILES notation for 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide?

The canonical SMILES for 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide is CC(C)NS(=O)(=O)c1ccc(-c2c(C#N)c3ccc(C(F)F)cc3n2C2CCC2)nc1.CCc1ccc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn3)n(C3CCC3)c2c1.COc1ccc(-n2c(-c3ccc(S(=O)(=O)NC(CF)CF)cn3)c(C#N)c3cc(F)ccc32)cc1.COc1ccc(-n2c(-c3ncc(S(=O)(=O)NC(CF)CF)cn3)c(C#N)c3cc(F)ccc32)cc1.C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3ccc(C(F)F)cc3n2C2CCC2)nc1)C(F)(F)F.C[C@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3ccc(C(F)F)cc3n2C2CCC2)nc1)C1CC1.

What is the InChIKey of 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide?

The InChIKey is BVPZPCROZQKJIX-PPHRCMDCSA-N. The full InChI is InChI=1S/C24H19F3N4O3S.C24H24F2N4O2S.C23H18F3N5O3S.C23H23F3N4O2S.C22H19F5N4O2S.C22H22F2N4O2S/c1-34-18-5-3-17(4-6-18)31-23-9-2-15(27)10-20(23)21(13-28)24(31)22-8-7-19(14-29-22)35(32,33)30-16(11-25)12-26;1-14(15-5-6-15)29-33(31,32)18-8-10-21(28-13-18)23-20(12-27)19-9-7-16(24(25)26)11-22(19)30(23)17-3-2-4-17;1-34-17-5-3-16(4-6-17)31-21-7-2-14(26)8-19(21)20(11-27)22(31)23-28-12-18(13-29-23)35(32,33)30-15(9-24)10-25;1-3-15-7-9-18-19(12-27)22(30(21(18)11-15)16-5-4-6-16)20-10-8-17(13-28-20)33(31,32)29-14(2)23(24,25)26;1-12(22(25,26)27)30-34(32,33)15-6-8-18(29-11-15)20-17(10-28)16-7-5-13(21(23)24)9-19(16)31(20)14-3-2-4-14;1-13(2)27-31(29,30)16-7-9-19(26-12-16)21-18(11-25)17-8-6-14(22(23)24)10-20(17)28(21)15-4-3-5-15/h2-10,14,16,30H,11-12H2,1H3;7-11,13-15,17,24,29H,2-6H2,1H3;2-8,12-13,15,30H,9-10H2,1H3;7-11,13-14,16,29H,3-6H2,1-2H3;5-9,11-12,14,21,30H,2-4H2,1H3;6-10,12-13,15,22,27H,3-5H2,1-2H3/t;14-;;14-;12-;/m.0.01./s1.

What are the key properties of 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide?

6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide has a molecular weight of 2892.04 g/mol, XLogP of 28.79, 41 rotatable bonds, 6 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(1S)-1-cyclopropylethyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-propan-2-ylpyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-6-(difluoromethyl)indol-2-yl]-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-ethylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;2-[3-cyano-5-fluoro-1-(4-methoxyphenyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 157476294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).