About 6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide
6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide (PubChem CID 157364623) has the molecular formula C131H128F16N30O12S6
and a molecular weight of 2811.03 g/mol. Its IUPAC name is 6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide.
Frequently Asked Questions
What is the IUPAC name of 6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide (CID 157364623) is 6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide is C[C@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(F)cnc3n2C2CCC2)nc1)C(F)(F)F.Cc1cnc2c(C#N)c(-c3ccc(S(=O)(=O)NC(C)(C)C(F)(F)F)cn3)n(C3CCCC3)c2c1.Cc1cnc2c(C#N)c(-c3ccc(S(=O)(=O)NC4(C(F)(F)F)CC4)cn3)n(C3CCCC3)c2c1.Cc1cnc2c(C#N)c(-c3ccc(S(=O)(=O)NC4(C)CC4)cn3)n(C3CCCC3)c2c1.Cc1cnc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn3)n(C3CCC3)c2c1.Cc1cnc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@H](C)C(F)(F)F)cn3)n(C3CCC3)c2c1.
What is the InChIKey of 6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide?
The InChIKey is BJAOSROFCBIJNQ-UKQLTESPSA-N. The full InChI is InChI=1S/C23H22F3N5O2S.C23H24F3N5O2S.C23H25N5O2S.2C21H20F3N5O2S.C20H17F4N5O2S/c1-14-10-19-20(29-12-14)17(11-27)21(31(19)15-4-2-3-5-15)18-7-6-16(13-28-18)34(32,33)30-22(8-9-22)23(24,25)26;1-14-10-19-20(29-12-14)17(11-27)21(31(19)15-6-4-5-7-15)18-9-8-16(13-28-18)34(32,33)30-22(2,3)23(24,25)26;1-15-11-20-21(26-13-15)18(12-24)22(28(20)16-5-3-4-6-16)19-8-7-17(14-25-19)31(29,30)27-23(2)9-10-23;2*1-12-8-18-19(27-10-12)16(9-25)20(29(18)14-4-3-5-14)17-7-6-15(11-26-17)32(30,31)28-13(2)21(22,23)24;1-11(20(22,23)24)28-32(30,31)14-5-6-17(26-10-14)18-16(8-25)15-7-12(21)9-27-19(15)29(18)13-3-2-4-13/h6-7,10,12-13,15,30H,2-5,8-9H2,1H3;8-10,12-13,15,30H,4-7H2,1-3H3;7-8,11,13-14,16,27H,3-6,9-10H2,1-2H3;2*6-8,10-11,13-14,28H,3-5H2,1-2H3;5-7,9-11,13,28H,2-4H2,1H3/t;;;2*13-;11-/m...100/s1.
What are the key properties of 6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide?
6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide has a molecular weight of 2811.03 g/mol, XLogP of 26.53, 30 rotatable bonds, 6 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-cyano-1-cyclobutyl-5-fluoropyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1-methylcyclopropyl)pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 157364623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).