2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide

C126H117Cl3F19N27O12S6 — CID 159274198

About 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide

2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide (PubChem CID 159274198) has the molecular formula C126H117Cl3F19N27O12S6 and a molecular weight of 2861.22 g/mol. Its IUPAC name is 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide.

Molecular Properties

• Compound Name: 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide
• PubChem CID: 159274198
• Molecular Formula: C126H117Cl3F19N27O12S6
• Molecular Weight: 2861.22 g/mol
• Exact Mass: 2857.65
• IUPAC Name: 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide
• SMILES: CC(C)n1c(-c2ncc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn2)c(C#N)c2cc(Cl)ccc21.CC(C)n1c(-c2ncc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn2)c(C#N)c2ccc(Cl)cc21.C[C@H](NS(=O)(=O)c1cnc(-c2c(C#N)c3cc(Cl)ccc3n2C2CCCC2)nc1)C(F)(F)F.Cc1ccc2c(C#N)c(-c3ccc(S(=O)(=O)NC(CF)CF)cn3)n(C3CCC3)c2c1F.Cc1ccc2c(C#N)c(-c3ccc(S(=O)(=O)NC(CF)CF)cn3)n(C3CCCC3)c2c1F.Cc1ccc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn3)n(C3CCC3)c2c1F
• InChI: InChI=1S/C23H23F3N4O2S.C22H20F4N4O2S.C22H21F3N4O2S.C21H19ClF3N5O2S.2C19H17ClF3N5O2S/c1-14-6-8-18-19(12-27)22(30(23(18)21(14)26)16-4-2-3-5-16)20-9-7-17(13-28-20)33(31,32)29-15(10-24)11-25;1-12-6-8-16-17(10-27)20(30(14-4-3-5-14)21(16)19(12)23)18-9-7-15(11-28-18)33(31,32)29-13(2)22(24,25)26;1-13-5-7-17-18(11-26)21(29(15-3-2-4-15)22(17)20(13)25)19-8-6-16(12-27-19)32(30,31)28-14(9-23)10-24;1-12(21(23,24)25)29-33(31,32)15-10-27-20(28-11-15)19-17(9-26)16-8-13(22)6-7-18(16)30(19)14-4-2-3-5-14;1-10(2)28-16-5-4-12(20)6-14(16)15(7-24)17(28)18-25-8-13(9-26-18)31(29,30)27-11(3)19(21,22)23;1-10(2)28-16-6-12(20)4-5-14(16)15(7-24)17(28)18-25-8-13(9-26-18)31(29,30)27-11(3)19(21,22)23/h6-9,13,15-16,29H,2-5,10-11H2,1H3;6-9,11,13-14,29H,3-5H2,1-2H3;5-8,12,14-15,28H,2-4,9-10H2,1H3;6-8,10-12,14,29H,2-5H2,1H3;2*4-6,8-11,27H,1-3H3/t;13-;;12-;2*11-/m.0.000/s1
• InChIKey: KYCASFJCESMEKH-ZHIJYXNQSA-N
• XLogP: 27.87
• TPSA: 565.35 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 33
• Rotatable Bonds: 34
• Heavy Atoms: 193
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2861.22
LogP ≤ 5	27.87
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?

The IUPAC name of 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide (CID 159274198) is 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide.

What is the SMILES notation for 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?

The canonical SMILES for 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide is CC(C)n1c(-c2ncc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn2)c(C#N)c2cc(Cl)ccc21.CC(C)n1c(-c2ncc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn2)c(C#N)c2ccc(Cl)cc21.C[C@H](NS(=O)(=O)c1cnc(-c2c(C#N)c3cc(Cl)ccc3n2C2CCCC2)nc1)C(F)(F)F.Cc1ccc2c(C#N)c(-c3ccc(S(=O)(=O)NC(CF)CF)cn3)n(C3CCC3)c2c1F.Cc1ccc2c(C#N)c(-c3ccc(S(=O)(=O)NC(CF)CF)cn3)n(C3CCCC3)c2c1F.Cc1ccc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn3)n(C3CCC3)c2c1F.

What is the InChIKey of 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?

The InChIKey is KYCASFJCESMEKH-ZHIJYXNQSA-N. The full InChI is InChI=1S/C23H23F3N4O2S.C22H20F4N4O2S.C22H21F3N4O2S.C21H19ClF3N5O2S.2C19H17ClF3N5O2S/c1-14-6-8-18-19(12-27)22(30(23(18)21(14)26)16-4-2-3-5-16)20-9-7-17(13-28-20)33(31,32)29-15(10-24)11-25;1-12-6-8-16-17(10-27)20(30(14-4-3-5-14)21(16)19(12)23)18-9-7-15(11-28-18)33(31,32)29-13(2)22(24,25)26;1-13-5-7-17-18(11-26)21(29(15-3-2-4-15)22(17)20(13)25)19-8-6-16(12-27-19)32(30,31)28-14(9-23)10-24;1-12(21(23,24)25)29-33(31,32)15-10-27-20(28-11-15)19-17(9-26)16-8-13(22)6-7-18(16)30(19)14-4-2-3-5-14;1-10(2)28-16-5-4-12(20)6-14(16)15(7-24)17(28)18-25-8-13(9-26-18)31(29,30)27-11(3)19(21,22)23;1-10(2)28-16-6-12(20)4-5-14(16)15(7-24)17(28)18-25-8-13(9-26-18)31(29,30)27-11(3)19(21,22)23/h6-9,13,15-16,29H,2-5,10-11H2,1H3;6-9,11,13-14,29H,3-5H2,1-2H3;5-8,12,14-15,28H,2-4,9-10H2,1H3;6-8,10-12,14,29H,2-5H2,1H3;2*4-6,8-11,27H,1-3H3/t;13-;;12-;2*11-/m.0.000/s1.

What are the key properties of 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?

2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide has a molecular weight of 2861.22 g/mol, XLogP of 27.87, 34 rotatable bonds, 6 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(5-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;2-(6-chloro-3-cyano-1-propan-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-7-fluoro-6-methylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-7-fluoro-6-methylindol-2-yl)-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 159274198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).