N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide

C102H127ClF5N19O16S4 — CID 158788009

About N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide

N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide (PubChem CID 158788009) has the molecular formula C102H127ClF5N19O16S4 and a molecular weight of 2133.97 g/mol. Its IUPAC name is N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
• PubChem CID: 158788009
• Molecular Formula: C102H127ClF5N19O16S4
• Molecular Weight: 2133.97 g/mol
• Exact Mass: 2131.82
• IUPAC Name: N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
• SMILES: CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)C3CCOC3)c(N3C[C@@H](C)CC3(C)C)n2)c1.CC(C)COc1cc(F)cc(-c2nc(N3C[C@@H](C)CC3(C)C)c(C(=O)NS(=O)(=O)c3cccc(N)n3)cc2Cl)c1.CC1(C)CN(c2ncc(C(F)(F)F)cc2C(=O)NS(=O)(=O)c2cccc(N)n2)C(C)(C)C1.Cc1cc(OC(C)C)nc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3C[C@@H](C)CC3(C)C)n2)c1
• InChI: InChI=1S/C28H33ClFN5O4S.C27H36FN3O5S.C27H34N6O4S.C20H24F3N5O3S/c1-16(2)15-39-20-10-18(9-19(30)11-20)25-22(29)12-21(26(33-25)35-14-17(3)13-28(35,4)5)27(36)34-40(37,38)24-8-6-7-23(31)32-24;1-17(2)15-36-21-11-19(10-20(28)12-21)24-7-6-23(25(29-24)31-14-18(3)13-27(31,4)5)26(32)30-37(33,34)22-8-9-35-16-22;1-16(2)37-23-13-17(3)12-21(29-23)20-11-10-19(25(30-20)33-15-18(4)14-27(33,5)6)26(34)32-38(35,36)24-9-7-8-22(28)31-24;1-18(2)10-19(3,4)28(11-18)16-13(8-12(9-25-16)20(21,22)23)17(29)27-32(30,31)15-7-5-6-14(24)26-15/h6-12,16-17H,13-15H2,1-5H3,(H2,31,32)(H,34,36);6-7,10-12,17-18,22H,8-9,13-16H2,1-5H3,(H,30,32);7-13,16,18H,14-15H2,1-6H3,(H2,28,31)(H,32,34);5-9H,10-11H2,1-4H3,(H2,24,26)(H,27,29)/t17-;18-,22?;18-;/m000./s1
• InChIKey: IRXQYTSRKFNSKP-YDEVTNKRSA-N
• XLogP: 16.86
• TPSA: 484.02 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 31
• Rotatable Bonds: 27
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2133.97
LogP ≤ 5	16.86
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

The IUPAC name of N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide (CID 158788009) is N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide.

What is the SMILES notation for N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

The canonical SMILES for N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide is CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)C3CCOC3)c(N3C[C@@H](C)CC3(C)C)n2)c1.CC(C)COc1cc(F)cc(-c2nc(N3C[C@@H](C)CC3(C)C)c(C(=O)NS(=O)(=O)c3cccc(N)n3)cc2Cl)c1.CC1(C)CN(c2ncc(C(F)(F)F)cc2C(=O)NS(=O)(=O)c2cccc(N)n2)C(C)(C)C1.Cc1cc(OC(C)C)nc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3C[C@@H](C)CC3(C)C)n2)c1.

What is the InChIKey of N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

The InChIKey is IRXQYTSRKFNSKP-YDEVTNKRSA-N. The full InChI is InChI=1S/C28H33ClFN5O4S.C27H36FN3O5S.C27H34N6O4S.C20H24F3N5O3S/c1-16(2)15-39-20-10-18(9-19(30)11-20)25-22(29)12-21(26(33-25)35-14-17(3)13-28(35,4)5)27(36)34-40(37,38)24-8-6-7-23(31)32-24;1-17(2)15-36-21-11-19(10-20(28)12-21)24-7-6-23(25(29-24)31-14-18(3)13-27(31,4)5)26(32)30-37(33,34)22-8-9-35-16-22;1-16(2)37-23-13-17(3)12-21(29-23)20-11-10-19(25(30-20)33-15-18(4)14-27(33,5)6)26(34)32-38(35,36)24-9-7-8-22(28)31-24;1-18(2)10-19(3,4)28(11-18)16-13(8-12(9-25-16)20(21,22)23)17(29)27-32(30,31)15-7-5-6-14(24)26-15/h6-12,16-17H,13-15H2,1-5H3,(H2,31,32)(H,34,36);6-7,10-12,17-18,22H,8-9,13-16H2,1-5H3,(H,30,32);7-13,16,18H,14-15H2,1-6H3,(H2,28,31)(H,32,34);5-9H,10-11H2,1-4H3,(H2,24,26)(H,27,29)/t17-;18-,22?;18-;/m000./s1.

What are the key properties of N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide has a molecular weight of 2133.97 g/mol, XLogP of 16.86, 27 rotatable bonds, 7 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(6-amino-2-pyridinyl)sulfonyl]-5-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(4-methyl-6-propan-2-yloxy-2-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-2-(2,2,4,4-tetramethylpyrrolidin-1-yl)-5-(trifluoromethyl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(oxolan-3-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 158788009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).