2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide

C118H123F11N20O12S5 — CID 160969458

About 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide

2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide (PubChem CID 160969458) has the molecular formula C118H123F11N20O12S5 and a molecular weight of 2388.76 g/mol. Its IUPAC name is 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide.

Molecular Properties

• Compound Name: 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
• PubChem CID: 160969458
• Molecular Formula: C118H123F11N20O12S5
• Molecular Weight: 2388.76 g/mol
• Exact Mass: 2386.84
• IUPAC Name: 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
• SMILES: CCc1cc(F)c2c(C(N)=O)c(-c3ccc(NS(=O)(=O)C(C)(C)C)nc3)n(-c3ccccc3)c2c1.Cc1cc2c(cc1F)c(C(N)=O)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cn1)n2C1CCCCC1.[2H]C(C)(C)NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(F)c(CC)cc3n2C2CCC2)nc1.[2H]C([2H])([2H])c1cc2c(cc1F)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@]([2H])(C)C(F)(F)F)cn1)n2C1CCC1.[2H][C@@](C)(NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(F)c(C)cc3n2C2CCC2)nc1)C(F)(F)F
• InChI: InChI=1S/C26H27FN4O3S.C25H31FN4O3S.C23H25FN4O2S.2C22H20F4N4O2S/c1-5-16-13-19(27)22-20(14-16)31(18-9-7-6-8-10-18)24(23(22)25(28)32)17-11-12-21(29-15-17)30-35(33,34)26(2,3)4;1-15-12-21-18(13-19(15)26)22(24(27)31)23(30(21)16-8-6-5-7-9-16)20-11-10-17(14-28-20)34(32,33)29-25(2,3)4;1-4-15-10-22-18(11-20(15)24)19(12-25)23(28(22)16-6-5-7-16)21-9-8-17(13-26-21)31(29,30)27-14(2)3;2*1-12-8-20-16(9-18(12)23)17(10-27)21(30(20)14-4-3-5-14)19-7-6-15(11-28-19)33(31,32)29-13(2)22(24,25)26/h6-15H,5H2,1-4H3,(H2,28,32)(H,29,30);10-14,16,29H,5-9H2,1-4H3,(H2,27,31);8-11,13-14,16,27H,4-7H2,1-3H3;2*6-9,11,13-14,29H,3-5H2,1-2H3/t;;;2*13-/m...00/s1/i;;14D;1D3,13D;13D
• InChIKey: SYBIEQKJQYTSPA-SIJBZVOJSA-N
• XLogP: 24.51
• TPSA: 477.50 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 25
• Rotatable Bonds: 28
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2388.76
LogP ≤ 5	24.51
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?

The IUPAC name of 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide (CID 160969458) is 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide.

What is the SMILES notation for 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?

The canonical SMILES for 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide is CCc1cc(F)c2c(C(N)=O)c(-c3ccc(NS(=O)(=O)C(C)(C)C)nc3)n(-c3ccccc3)c2c1.Cc1cc2c(cc1F)c(C(N)=O)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cn1)n2C1CCCCC1.[2H]C(C)(C)NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(F)c(CC)cc3n2C2CCC2)nc1.[2H]C([2H])([2H])c1cc2c(cc1F)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@]([2H])(C)C(F)(F)F)cn1)n2C1CCC1.[2H][C@@](C)(NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(F)c(C)cc3n2C2CCC2)nc1)C(F)(F)F.

What is the InChIKey of 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?

The InChIKey is SYBIEQKJQYTSPA-SIJBZVOJSA-N. The full InChI is InChI=1S/C26H27FN4O3S.C25H31FN4O3S.C23H25FN4O2S.2C22H20F4N4O2S/c1-5-16-13-19(27)22-20(14-16)31(18-9-7-6-8-10-18)24(23(22)25(28)32)17-11-12-21(29-15-17)30-35(33,34)26(2,3)4;1-15-12-21-18(13-19(15)26)22(24(27)31)23(30(21)16-8-6-5-7-9-16)20-11-10-17(14-28-20)34(32,33)29-25(2,3)4;1-4-15-10-22-18(11-20(15)24)19(12-25)23(28(22)16-6-5-7-16)21-9-8-17(13-26-21)31(29,30)27-14(2)3;2*1-12-8-20-16(9-18(12)23)17(10-27)21(30(20)14-4-3-5-14)19-7-6-15(11-28-19)33(31,32)29-13(2)22(24,25)26/h6-15H,5H2,1-4H3,(H2,28,32)(H,29,30);10-14,16,29H,5-9H2,1-4H3,(H2,27,31);8-11,13-14,16,27H,4-7H2,1-3H3;2*6-9,11,13-14,29H,3-5H2,1-2H3/t;;;2*13-/m...00/s1/i;;14D;1D3,13D;13D.

What are the key properties of 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?

2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide has a molecular weight of 2388.76 g/mol, XLogP of 24.51, 28 rotatable bonds, 7 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-(tert-butylsulfamoyl)-2-pyridinyl]-1-cyclohexyl-5-fluoro-6-methylindole-3-carboxamide;2-[6-(tert-butylsulfonylamino)-3-pyridinyl]-6-ethyl-4-fluoro-1-phenylindole-3-carboxamide;6-(3-cyano-1-cyclobutyl-6-ethyl-5-fluoroindol-2-yl)-N-(2-deuteriopropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-5-fluoro-6-methylindol-2-yl)-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-fluoro-6-(trideuteriomethyl)indol-2-yl]-N-[(2S)-2-deuterio-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 160969458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).