N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen

C76H94F9N13O13S3 — CID 158470064

About N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen

N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen (PubChem CID 158470064) has the molecular formula C76H94F9N13O13S3 and a molecular weight of 1664.85 g/mol. Its IUPAC name is N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen.

Molecular Properties

• Compound Name: N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen
• PubChem CID: 158470064
• Molecular Formula: C76H94F9N13O13S3
• Molecular Weight: 1664.85 g/mol
• Exact Mass: 1663.61
• IUPAC Name: N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen
• SMILES: CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N(C)[C@H](C)C(F)(F)F)n2)c1.CCN(c1nc(-c2cc(F)cc(OCC(C)C)c2)ccc1C(=O)NS(=O)(=O)c1cccc(N)n1)C(C)C.Cc1cccc(S(=O)(=O)NC(=O)c2ccc(-c3cc(F)cc(OCC(C)C)c3)nc2OC(C)C(F)(F)F)n1.[H][H].[H][H].[H][H].[H][H].[H][H]
• InChI: InChI=1S/C26H32FN5O4S.C25H27F4N5O4S.C25H25F4N3O5S.5H2/c1-6-32(17(4)5)25-21(26(33)31-37(34,35)24-9-7-8-23(28)30-24)10-11-22(29-25)18-12-19(27)14-20(13-18)36-15-16(2)3;1-14(2)13-38-18-11-16(10-17(26)12-18)20-9-8-19(23(31-20)34(4)15(3)25(27,28)29)24(35)33-39(36,37)22-7-5-6-21(30)32-22;1-14(2)13-36-19-11-17(10-18(26)12-19)21-9-8-20(24(31-21)37-16(4)25(27,28)29)23(33)32-38(34,35)22-7-5-6-15(3)30-22;;;;;/h7-14,16-17H,6,15H2,1-5H3,(H2,28,30)(H,31,33);5-12,14-15H,13H2,1-4H3,(H2,30,32)(H,33,35);5-12,14,16H,13H2,1-4H3,(H,32,33);5*1H/t;15-;;;;;;/m.1....../s1
• InChIKey: HGFYSTMDSHLUJX-VACLILGRSA-N
• XLogP: 14.96
• TPSA: 362.50 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 23
• Rotatable Bonds: 28
• Heavy Atoms: 114
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1664.85
LogP ≤ 5	14.96
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen?

The IUPAC name of N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen (CID 158470064) is N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen.

What is the SMILES notation for N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen?

The canonical SMILES for N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen is CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N(C)[C@H](C)C(F)(F)F)n2)c1.CCN(c1nc(-c2cc(F)cc(OCC(C)C)c2)ccc1C(=O)NS(=O)(=O)c1cccc(N)n1)C(C)C.Cc1cccc(S(=O)(=O)NC(=O)c2ccc(-c3cc(F)cc(OCC(C)C)c3)nc2OC(C)C(F)(F)F)n1.[H][H].[H][H].[H][H].[H][H].[H][H].

What is the InChIKey of N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen?

The InChIKey is HGFYSTMDSHLUJX-VACLILGRSA-N. The full InChI is InChI=1S/C26H32FN5O4S.C25H27F4N5O4S.C25H25F4N3O5S.5H2/c1-6-32(17(4)5)25-21(26(33)31-37(34,35)24-9-7-8-23(28)30-24)10-11-22(29-25)18-12-19(27)14-20(13-18)36-15-16(2)3;1-14(2)13-38-18-11-16(10-17(26)12-18)20-9-8-19(23(31-20)34(4)15(3)25(27,28)29)24(35)33-39(36,37)22-7-5-6-21(30)32-22;1-14(2)13-36-19-11-17(10-18(26)12-19)21-9-8-20(24(31-21)37-16(4)25(27,28)29)23(33)32-38(34,35)22-7-5-6-15(3)30-22;;;;;/h7-14,16-17H,6,15H2,1-5H3,(H2,28,30)(H,31,33);5-12,14-15H,13H2,1-4H3,(H2,30,32)(H,33,35);5-12,14,16H,13H2,1-4H3,(H,32,33);5*1H/t;15-;;;;;;/m.1....../s1.

What are the key properties of N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen?

N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen has a molecular weight of 1664.85 g/mol, XLogP of 14.96, 28 rotatable bonds, 5 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(6-amino-2-pyridinyl)sulfonyl]-2-[ethyl(propan-2-yl)amino]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[methyl-[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-[(6-methyl-2-pyridinyl)sulfonyl]-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide;molecular hydrogen is sourced from PubChem (CID 158470064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).