N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide

C137H157ClF5N24O22S5+ — CID 158732201

About N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide

N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide (PubChem CID 158732201) has the molecular formula C137H157ClF5N24O22S5+ and a molecular weight of 2782.69 g/mol. Its IUPAC name is N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
• PubChem CID: 158732201
• Molecular Formula: C137H157ClF5N24O22S5+
• Molecular Weight: 2782.69 g/mol
• Exact Mass: 2780.01
• IUPAC Name: N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
• SMILES: CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CC(C(C)(C)C)CC3(C)C)n2)c1.CC(C)Oc1ccccc1-c1ccc(C(=O)NS(=O)(=O)c2ccc[nH]c2=O)c(N2C[C@@H](C)CC2(C)C)n1.CCCOc1cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(NC(=O)CCC#N)[nH+]3)c(N3[C@H](C)CC[C@@H]3C)n2)ccc1Cl.C[C@@H]1CN(c2nc(-c3ccccc3F)ccc2C(=O)NS(=O)(=O)c2ccc[nH]c2=O)C(C)(C)C1.C[C@@H]1CN(c2nc(-c3ccccc3OC(F)(F)F)ccc2C(=O)NS(=O)(=O)c2cccnc2N)C(C)(C)C1
• InChI: InChI=1S/C31H40FN5O4S.C30H33ClN6O5S.C27H32N4O5S.C25H26F3N5O4S.C24H25FN4O4S/c1-19(2)18-41-23-14-20(13-22(32)15-23)25-12-11-24(29(38)36-42(39,40)27-10-8-9-26(33)35-27)28(34-25)37-17-21(30(3,4)5)16-31(37,6)7;1-4-17-42-25-18-21(12-14-23(25)31)24-15-13-22(29(33-24)37-19(2)10-11-20(37)3)30(39)36-43(40,41)28-9-5-7-26(35-28)34-27(38)8-6-16-32;1-17(2)36-22-10-7-6-9-19(22)21-13-12-20(24(29-21)31-16-18(3)15-27(31,4)5)25(32)30-37(34,35)23-11-8-14-28-26(23)33;1-15-13-24(2,3)33(14-15)22-17(23(34)32-38(35,36)20-9-6-12-30-21(20)29)10-11-18(31-22)16-7-4-5-8-19(16)37-25(26,27)28;1-15-13-24(2,3)29(14-15)21-17(10-11-19(27-21)16-7-4-5-8-18(16)25)22(30)28-34(32,33)20-9-6-12-26-23(20)31/h8-15,19,21H,16-18H2,1-7H3,(H2,33,35)(H,36,38);5,7,9,12-15,18-20H,4,6,8,10-11,17H2,1-3H3,(H,36,39)(H,34,35,38);6-14,17-18H,15-16H2,1-5H3,(H,28,33)(H,30,32);4-12,15H,13-14H2,1-3H3,(H2,29,30)(H,32,34);4-12,15H,13-14H2,1-3H3,(H,26,31)(H,28,30)/p+1/t;19-,20+;18-;2*15-/m..000/s1
• InChIKey: ANECSMMLTVYCPO-KAEIEFBNSA-O
• XLogP: 22.07
• TPSA: 644.34 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 37
• Rotatable Bonds: 37
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2782.69
LogP ≤ 5	22.07
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	37

Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

The IUPAC name of N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide (CID 158732201) is N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide.

What is the SMILES notation for N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

The canonical SMILES for N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide is CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CC(C(C)(C)C)CC3(C)C)n2)c1.CC(C)Oc1ccccc1-c1ccc(C(=O)NS(=O)(=O)c2ccc[nH]c2=O)c(N2C[C@@H](C)CC2(C)C)n1.CCCOc1cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(NC(=O)CCC#N)[nH+]3)c(N3[C@H](C)CC[C@@H]3C)n2)ccc1Cl.C[C@@H]1CN(c2nc(-c3ccccc3F)ccc2C(=O)NS(=O)(=O)c2ccc[nH]c2=O)C(C)(C)C1.C[C@@H]1CN(c2nc(-c3ccccc3OC(F)(F)F)ccc2C(=O)NS(=O)(=O)c2cccnc2N)C(C)(C)C1.

What is the InChIKey of N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

The InChIKey is ANECSMMLTVYCPO-KAEIEFBNSA-O. The full InChI is InChI=1S/C31H40FN5O4S.C30H33ClN6O5S.C27H32N4O5S.C25H26F3N5O4S.C24H25FN4O4S/c1-19(2)18-41-23-14-20(13-22(32)15-23)25-12-11-24(29(38)36-42(39,40)27-10-8-9-26(33)35-27)28(34-25)37-17-21(30(3,4)5)16-31(37,6)7;1-4-17-42-25-18-21(12-14-23(25)31)24-15-13-22(29(33-24)37-19(2)10-11-20(37)3)30(39)36-43(40,41)28-9-5-7-26(35-28)34-27(38)8-6-16-32;1-17(2)36-22-10-7-6-9-19(22)21-13-12-20(24(29-21)31-16-18(3)15-27(31,4)5)25(32)30-37(34,35)23-11-8-14-28-26(23)33;1-15-13-24(2,3)33(14-15)22-17(23(34)32-38(35,36)20-9-6-12-30-21(20)29)10-11-18(31-22)16-7-4-5-8-19(16)37-25(26,27)28;1-15-13-24(2,3)29(14-15)21-17(10-11-19(27-21)16-7-4-5-8-18(16)25)22(30)28-34(32,33)20-9-6-12-26-23(20)31/h8-15,19,21H,16-18H2,1-7H3,(H2,33,35)(H,36,38);5,7,9,12-15,18-20H,4,6,8,10-11,17H2,1-3H3,(H,36,39)(H,34,35,38);6-14,17-18H,15-16H2,1-5H3,(H,28,33)(H,30,32);4-12,15H,13-14H2,1-3H3,(H2,29,30)(H,32,34);4-12,15H,13-14H2,1-3H3,(H,26,31)(H,28,30)/p+1/t;19-,20+;18-;2*15-/m..000/s1.

What are the key properties of N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide has a molecular weight of 2782.69 g/mol, XLogP of 22.07, 37 rotatable bonds, 10 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(6-amino-2-pyridinyl)sulfonyl]-2-(4-tert-butyl-2,2-dimethylpyrrolidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(2-amino-3-pyridinyl)sulfonyl]-6-[2-(trifluoromethoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(4-chloro-3-propoxyphenyl)-N-[6-(3-cyanopropanoylamino)pyridin-1-ium-2-yl]sulfonyl-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;6-(2-fluorophenyl)-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-6-(2-propan-2-yloxyphenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 158732201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).