2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide

C97H75Cl6F18N25O10S — CID 158424420

About 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide

2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide (PubChem CID 158424420) has the molecular formula C97H75Cl6F18N25O10S and a molecular weight of 2337.58 g/mol. Its IUPAC name is 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide.

Molecular Properties

• Compound Name: 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide
• PubChem CID: 158424420
• Molecular Formula: C97H75Cl6F18N25O10S
• Molecular Weight: 2337.58 g/mol
• Exact Mass: 2333.37
• IUPAC Name: 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide
• SMILES: CN1CCN(S(=O)(=O)c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cc2)CC1.COc1cc(OC)cc(C(=O)Nc2ncn(-c3ncc(C(F)(F)F)cc3Cl)n2)c1.Cc1nc(NCCCN2CCCC2=O)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1.O=C(Nc1ncn(-c2ncc(C(F)(F)F)cc2Cl)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1.O=C(Nc1ncn(-c2ncc(C(F)(F)F)cc2Cl)n1)c1ccc(C(F)(F)F)nc1Cl
• InChI: InChI=1S/C25H26ClN5O2.C23H23ClN4O3S.C17H7ClF9N5O.C17H13ClF3N5O3.C15H6Cl2F6N6O/c1-17-19(9-11-23(29-17)28-13-5-15-31-14-4-7-24(31)32)25(33)30-18-8-10-21(26)20(16-18)22-6-2-3-12-27-22;1-27-12-14-28(15-13-27)32(30,31)19-8-5-17(6-9-19)23(29)26-18-7-10-21(24)20(16-18)22-4-2-3-11-25-22;18-11-4-10(17(25,26)27)5-28-12(11)32-6-29-14(31-32)30-13(33)7-1-8(15(19,20)21)3-9(2-7)16(22,23)24;1-28-11-3-9(4-12(6-11)29-2)15(27)24-16-23-8-26(25-16)14-13(18)5-10(7-22-14)17(19,20)21;16-8-3-6(14(18,19)20)4-24-11(8)29-5-25-13(28-29)27-12(30)7-1-2-9(15(21,22)23)26-10(7)17/h2-3,6,8-12,16H,4-5,7,13-15H2,1H3,(H,28,29)(H,30,33);2-11,16H,12-15H2,1H3,(H,26,29);1-6H,(H,30,31,33);3-8H,1-2H3,(H,24,25,27);1-5H,(H,27,28,30)
• InChIKey: HAWKXOJAUPETBB-UHFFFAOYSA-N
• XLogP: 22.25
• TPSA: 419.28 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 28
• Rotatable Bonds: 24
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2337.58
LogP ≤ 5	22.25
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide?

The IUPAC name of 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide (CID 158424420) is 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide.

What is the SMILES notation for 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide?

The canonical SMILES for 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide is CN1CCN(S(=O)(=O)c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cc2)CC1.COc1cc(OC)cc(C(=O)Nc2ncn(-c3ncc(C(F)(F)F)cc3Cl)n2)c1.Cc1nc(NCCCN2CCCC2=O)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1.O=C(Nc1ncn(-c2ncc(C(F)(F)F)cc2Cl)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1.O=C(Nc1ncn(-c2ncc(C(F)(F)F)cc2Cl)n1)c1ccc(C(F)(F)F)nc1Cl.

What is the InChIKey of 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide?

The InChIKey is HAWKXOJAUPETBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26ClN5O2.C23H23ClN4O3S.C17H7ClF9N5O.C17H13ClF3N5O3.C15H6Cl2F6N6O/c1-17-19(9-11-23(29-17)28-13-5-15-31-14-4-7-24(31)32)25(33)30-18-8-10-21(26)20(16-18)22-6-2-3-12-27-22;1-27-12-14-28(15-13-27)32(30,31)19-8-5-17(6-9-19)23(29)26-18-7-10-21(24)20(16-18)22-4-2-3-11-25-22;18-11-4-10(17(25,26)27)5-28-12(11)32-6-29-14(31-32)30-13(33)7-1-8(15(19,20)21)3-9(2-7)16(22,23)24;1-28-11-3-9(4-12(6-11)29-2)15(27)24-16-23-8-26(25-16)14-13(18)5-10(7-22-14)17(19,20)21;16-8-3-6(14(18,19)20)4-24-11(8)29-5-25-13(28-29)27-12(30)7-1-2-9(15(21,22)23)26-10(7)17/h2-3,6,8-12,16H,4-5,7,13-15H2,1H3,(H,28,29)(H,30,33);2-11,16H,12-15H2,1H3,(H,26,29);1-6H,(H,30,31,33);3-8H,1-2H3,(H,24,25,27);1-5H,(H,27,28,30).

What are the key properties of 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide?

2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide has a molecular weight of 2337.58 g/mol, XLogP of 22.25, 24 rotatable bonds, 6 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-[3-(2-oxopyrrolidin-1-yl)propylamino]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-bis(trifluoromethyl)benzamide;N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-triazol-3-yl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 158424420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).