N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide

C80H96F3N17O13S3 — CID 157337838

About N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide

N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide (PubChem CID 157337838) has the molecular formula C80H96F3N17O13S3 and a molecular weight of 1656.95 g/mol. Its IUPAC name is N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide
• PubChem CID: 157337838
• Molecular Formula: C80H96F3N17O13S3
• Molecular Weight: 1656.95 g/mol
• Exact Mass: 1655.65
• IUPAC Name: N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide
• SMILES: CC(=O)Cc1ncccc1S(=O)(=O)NC(=O)c1ccc(-c2ccc(OC(C)C)nc2)nc1N1C[C@@H](C)CC1(C)C.CC1CN(c2ncccc2C(=O)NS(=O)(=O)c2cccc(Nc3ccc(OC(F)(F)F)cc3)n2)C(C)(C)C1.C[C@@H]1CN(c2nc(-n3ccc(OCC(C)(C)C)n3)ccc2C(=O)NS(=O)(=O)c2cccnc2N)C(C)(C)C1
• InChI: InChI=1S/C29H35N5O5S.C26H35N7O4S.C25H26F3N5O4S/c1-18(2)39-26-12-9-21(16-31-26)23-11-10-22(27(32-23)34-17-19(3)15-29(34,5)6)28(36)33-40(37,38)25-8-7-13-30-24(25)14-20(4)35;1-17-14-26(5,6)32(15-17)23-18(24(34)31-38(35,36)19-8-7-12-28-22(19)27)9-10-20(29-23)33-13-11-21(30-33)37-16-25(2,3)4;1-16-14-24(2,3)33(15-16)22-19(6-5-13-29-22)23(34)32-38(35,36)21-8-4-7-20(31-21)30-17-9-11-18(12-10-17)37-25(26,27)28/h7-13,16,18-19H,14-15,17H2,1-6H3,(H,33,36);7-13,17H,14-16H2,1-6H3,(H2,27,28)(H,31,34);4-13,16H,14-15H2,1-3H3,(H,30,31)(H,32,34)/t19-;17-;/m00./s1
• InChIKey: BGAXGVBCXWBKMC-CJCXVOEWSA-N
• XLogP: 12.48
• TPSA: 390.30 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 27
• Rotatable Bonds: 23
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1656.95
LogP ≤ 5	12.48
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide?

The IUPAC name of N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide (CID 157337838) is N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide.

What is the SMILES notation for N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide?

The canonical SMILES for N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide is CC(=O)Cc1ncccc1S(=O)(=O)NC(=O)c1ccc(-c2ccc(OC(C)C)nc2)nc1N1C[C@@H](C)CC1(C)C.CC1CN(c2ncccc2C(=O)NS(=O)(=O)c2cccc(Nc3ccc(OC(F)(F)F)cc3)n2)C(C)(C)C1.C[C@@H]1CN(c2nc(-n3ccc(OCC(C)(C)C)n3)ccc2C(=O)NS(=O)(=O)c2cccnc2N)C(C)(C)C1.

What is the InChIKey of N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide?

The InChIKey is BGAXGVBCXWBKMC-CJCXVOEWSA-N. The full InChI is InChI=1S/C29H35N5O5S.C26H35N7O4S.C25H26F3N5O4S/c1-18(2)39-26-12-9-21(16-31-26)23-11-10-22(27(32-23)34-17-19(3)15-29(34,5)6)28(36)33-40(37,38)25-8-7-13-30-24(25)14-20(4)35;1-17-14-26(5,6)32(15-17)23-18(24(34)31-38(35,36)19-8-7-12-28-22(19)27)9-10-20(29-23)33-13-11-21(30-33)37-16-25(2,3)4;1-16-14-24(2,3)33(15-16)22-19(6-5-13-29-22)23(34)32-38(35,36)21-8-4-7-20(31-21)30-17-9-11-18(12-10-17)37-25(26,27)28/h7-13,16,18-19H,14-15,17H2,1-6H3,(H,33,36);7-13,17H,14-16H2,1-6H3,(H2,27,28)(H,31,34);4-13,16H,14-15H2,1-3H3,(H,30,31)(H,32,34)/t19-;17-;/m00./s1.

What are the key properties of N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide?

N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide has a molecular weight of 1656.95 g/mol, XLogP of 12.48, 23 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2-amino-3-pyridinyl)sulfonyl]-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[2-(2-oxopropyl)-3-pyridinyl]sulfonyl]-6-(6-propan-2-yloxy-3-pyridinyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[[6-[4-(trifluoromethoxy)anilino]-2-pyridinyl]sulfonyl]-2-(2,2,4-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 157337838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).