6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen

C128H116Cl4F19N25O12S6 — CID 158214827

About 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen

6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen (PubChem CID 158214827) has the molecular formula C128H116Cl4F19N25O12S6 and a molecular weight of 2891.67 g/mol. Its IUPAC name is 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen.

Molecular Properties

• Compound Name: 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen
• PubChem CID: 158214827
• Molecular Formula: C128H116Cl4F19N25O12S6
• Molecular Weight: 2891.67 g/mol
• Exact Mass: 2887.60
• IUPAC Name: 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen
• SMILES: C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(Cl)ccc3n2C2CCCC2)nc1)C(F)(F)F.C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(F)ccc3n2C2CCC2)nc1)C(F)(F)F.C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(F)ccc3n2C2CCCC2)nc1)C(F)(F)F.C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3ccc(Cl)cc3n2C2CCC2)nc1)C(F)(F)F.C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3ccc(Cl)cc3n2C2CCCC2)nc1)C(F)(F)F.N#Cc1c(-c2ncc(S(=O)(=O)NC(CF)CF)cn2)n(CC2CC2)c2ccc(Cl)cc12.[H][H]
• InChI: InChI=1S/2C22H20ClF3N4O2S.C22H20F4N4O2S.C21H18ClF3N4O2S.C21H18F4N4O2S.C20H18ClF2N5O2S.H2/c1-13(22(24,25)26)29-33(31,32)16-7-8-19(28-12-16)21-18(11-27)17-10-14(23)6-9-20(17)30(21)15-4-2-3-5-15;1-13(22(24,25)26)29-33(31,32)16-7-9-19(28-12-16)21-18(11-27)17-8-6-14(23)10-20(17)30(21)15-4-2-3-5-15;1-13(22(24,25)26)29-33(31,32)16-7-8-19(28-12-16)21-18(11-27)17-10-14(23)6-9-20(17)30(21)15-4-2-3-5-15;1-12(21(23,24)25)28-32(30,31)15-6-8-18(27-11-15)20-17(10-26)16-7-5-13(22)9-19(16)29(20)14-3-2-4-14;1-12(21(23,24)25)28-32(30,31)15-6-7-18(27-11-15)20-17(10-26)16-9-13(22)5-8-19(16)29(20)14-3-2-4-14;21-13-3-4-18-16(5-13)17(8-24)19(28(18)11-12-1-2-12)20-25-9-15(10-26-20)31(29,30)27-14(6-22)7-23;/h3*6-10,12-13,15,29H,2-5H2,1H3;2*5-9,11-12,14,28H,2-4H2,1H3;3-5,9-10,12,14,27H,1-2,6-7,11H2;1H/t3*13-;2*12-;;/m11111../s1
• InChIKey: GCNCRGLYZOJVMK-MPWMOZJASA-N
• XLogP: 29.92
• TPSA: 539.57 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 31
• Rotatable Bonds: 33
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2891.67
LogP ≤ 5	29.92
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen?

The IUPAC name of 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen (CID 158214827) is 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen.

What is the SMILES notation for 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen?

The canonical SMILES for 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen is C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(Cl)ccc3n2C2CCCC2)nc1)C(F)(F)F.C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(F)ccc3n2C2CCC2)nc1)C(F)(F)F.C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(F)ccc3n2C2CCCC2)nc1)C(F)(F)F.C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3ccc(Cl)cc3n2C2CCC2)nc1)C(F)(F)F.C[C@@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3ccc(Cl)cc3n2C2CCCC2)nc1)C(F)(F)F.N#Cc1c(-c2ncc(S(=O)(=O)NC(CF)CF)cn2)n(CC2CC2)c2ccc(Cl)cc12.[H][H].

What is the InChIKey of 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen?

The InChIKey is GCNCRGLYZOJVMK-MPWMOZJASA-N. The full InChI is InChI=1S/2C22H20ClF3N4O2S.C22H20F4N4O2S.C21H18ClF3N4O2S.C21H18F4N4O2S.C20H18ClF2N5O2S.H2/c1-13(22(24,25)26)29-33(31,32)16-7-8-19(28-12-16)21-18(11-27)17-10-14(23)6-9-20(17)30(21)15-4-2-3-5-15;1-13(22(24,25)26)29-33(31,32)16-7-9-19(28-12-16)21-18(11-27)17-8-6-14(23)10-20(17)30(21)15-4-2-3-5-15;1-13(22(24,25)26)29-33(31,32)16-7-8-19(28-12-16)21-18(11-27)17-10-14(23)6-9-20(17)30(21)15-4-2-3-5-15;1-12(21(23,24)25)28-32(30,31)15-6-8-18(27-11-15)20-17(10-26)16-7-5-13(22)9-19(16)29(20)14-3-2-4-14;1-12(21(23,24)25)28-32(30,31)15-6-7-18(27-11-15)20-17(10-26)16-9-13(22)5-8-19(16)29(20)14-3-2-4-14;21-13-3-4-18-16(5-13)17(8-24)19(28(18)11-12-1-2-12)20-25-9-15(10-26-20)31(29,30)27-14(6-22)7-23;/h3*6-10,12-13,15,29H,2-5H2,1H3;2*5-9,11-12,14,28H,2-4H2,1H3;3-5,9-10,12,14,27H,1-2,6-7,11H2;1H/t3*13-;2*12-;;/m11111../s1.

What are the key properties of 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen?

6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen has a molecular weight of 2891.67 g/mol, XLogP of 29.92, 33 rotatable bonds, 6 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(6-chloro-3-cyano-1-cyclobutylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(5-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(6-chloro-3-cyano-1-cyclopentylindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;2-[5-chloro-3-cyano-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyrimidine-5-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-fluoroindol-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;molecular hydrogen is sourced from PubChem (CID 158214827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).