N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide

C86H98F2N14O13S3 — CID 159578859

About N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide

N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide (PubChem CID 159578859) has the molecular formula C86H98F2N14O13S3 and a molecular weight of 1670.01 g/mol. Its IUPAC name is N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
• PubChem CID: 159578859
• Molecular Formula: C86H98F2N14O13S3
• Molecular Weight: 1670.01 g/mol
• Exact Mass: 1668.66
• IUPAC Name: N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
• SMILES: CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3ccc[nH]c3=O)c(N3C[C@H](C)CC3(C)C)n2)c1.CC(C)Oc1ccc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)c3)c(N3C(C)CC(c4ccccc4)C3C)n2)cn1.CC1CCN(c2nc(-c3cc(F)cc(OC(C)C)c3)ccc2C(=O)NS(=O)(=O)c2cccc(N)n2)CC1
• InChI: InChI=1S/C32H35N5O4S.C28H33FN4O5S.C26H30FN5O4S/c1-20(2)41-30-16-13-24(19-34-30)29-15-14-27(32(38)36-42(39,40)26-12-8-11-25(33)18-26)31(35-29)37-21(3)17-28(22(37)4)23-9-6-5-7-10-23;1-17(2)16-38-21-12-19(11-20(29)13-21)23-9-8-22(25(31-23)33-15-18(3)14-28(33,4)5)26(34)32-39(36,37)24-7-6-10-30-27(24)35;1-16(2)36-20-14-18(13-19(27)15-20)22-8-7-21(25(29-22)32-11-9-17(3)10-12-32)26(33)31-37(34,35)24-6-4-5-23(28)30-24/h5-16,18-22,28H,17,33H2,1-4H3,(H,36,38);6-13,17-18H,14-16H2,1-5H3,(H,30,35)(H,32,34);4-8,13-17H,9-12H2,1-3H3,(H2,28,30)(H,31,33)/t;18-;/m.1./s1
• InChIKey: MITCLEIXRRPRMQ-SKRVEHMLSA-N
• XLogP: 13.76
• TPSA: 376.48 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 23
• Rotatable Bonds: 23
• Heavy Atoms: 118
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1670.01
LogP ≤ 5	13.76
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

The IUPAC name of N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide (CID 159578859) is N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide.

What is the SMILES notation for N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

The canonical SMILES for N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide is CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3ccc[nH]c3=O)c(N3C[C@H](C)CC3(C)C)n2)c1.CC(C)Oc1ccc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)c3)c(N3C(C)CC(c4ccccc4)C3C)n2)cn1.CC1CCN(c2nc(-c3cc(F)cc(OC(C)C)c3)ccc2C(=O)NS(=O)(=O)c2cccc(N)n2)CC1.

What is the InChIKey of N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

The InChIKey is MITCLEIXRRPRMQ-SKRVEHMLSA-N. The full InChI is InChI=1S/C32H35N5O4S.C28H33FN4O5S.C26H30FN5O4S/c1-20(2)41-30-16-13-24(19-34-30)29-15-14-27(32(38)36-42(39,40)26-12-8-11-25(33)18-26)31(35-29)37-21(3)17-28(22(37)4)23-9-6-5-7-10-23;1-17(2)16-38-21-12-19(11-20(29)13-21)23-9-8-22(25(31-23)33-15-18(3)14-28(33,4)5)26(34)32-39(36,37)24-7-6-10-30-27(24)35;1-16(2)36-20-14-18(13-19(27)15-20)22-8-7-21(25(29-22)32-11-9-17(3)10-12-32)26(33)31-37(34,35)24-6-4-5-23(28)30-24/h5-16,18-22,28H,17,33H2,1-4H3,(H,36,38);6-13,17-18H,14-16H2,1-5H3,(H,30,35)(H,32,34);4-8,13-17H,9-12H2,1-3H3,(H2,28,30)(H,31,33)/t;18-;/m.1./s1.

What are the key properties of N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?

N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide has a molecular weight of 1670.01 g/mol, XLogP of 13.76, 23 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-aminophenyl)sulfonyl-2-(2,5-dimethyl-3-phenylpyrrolidin-1-yl)-6-(6-propan-2-yloxy-3-pyridinyl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-2-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(2-oxo-1H-pyridin-3-yl)sulfonyl]-2-[(4R)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 159578859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).