N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide

C76H66Cl4F6N14O6 — CID 160720188

About N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide

N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide (PubChem CID 160720188) has the molecular formula C76H66Cl4F6N14O6 and a molecular weight of 1527.26 g/mol. Its IUPAC name is N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide.

Molecular Properties

• Compound Name: N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide
• PubChem CID: 160720188
• Molecular Formula: C76H66Cl4F6N14O6
• Molecular Weight: 1527.26 g/mol
• Exact Mass: 1524.39
• IUPAC Name: N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide
• SMILES: COc1cc(C)cc(C(=O)Nc2ncn(-c3ncc(C)cc3Cl)n2)c1.COc1cc(OC)cc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c1.Cc1cc(C(=O)Nc2ncn(-c3ncc(C)cc3Cl)n2)cc(C(F)(F)F)c1.Cc1cc(CCCNc2ccc(Cl)c(-c3ccccn3)c2)cc(C(F)(F)F)c1
• InChI: InChI=1S/C22H20ClF3N2.C20H17ClN2O3.C17H13ClF3N5O.C17H16ClN5O2/c1-15-11-16(13-17(12-15)22(24,25)26)5-4-10-27-18-7-8-20(23)19(14-18)21-6-2-3-9-28-21;1-25-15-9-13(10-16(12-15)26-2)20(24)23-14-6-7-18(21)17(11-14)19-5-3-4-8-22-19;1-9-3-11(6-12(4-9)17(19,20)21)15(27)24-16-23-8-26(25-16)14-13(18)5-10(2)7-22-14;1-10-4-12(7-13(5-10)25-3)16(24)21-17-20-9-23(22-17)15-14(18)6-11(2)8-19-15/h2-3,6-9,11-14,27H,4-5,10H2,1H3;3-12H,1-2H3,(H,23,24);3-8H,1-2H3,(H,24,25,27);4-9H,1-3H3,(H,21,22,24)
• InChIKey: RSZQNLQIZFVTJL-UHFFFAOYSA-N
• XLogP: 18.84
• TPSA: 240.00 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 17
• Rotatable Bonds: 18
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1527.26
LogP ≤ 5	18.84
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide?

The IUPAC name of N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide (CID 160720188) is N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide.

What is the SMILES notation for N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide?

The canonical SMILES for N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide is COc1cc(C)cc(C(=O)Nc2ncn(-c3ncc(C)cc3Cl)n2)c1.COc1cc(OC)cc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c1.Cc1cc(C(=O)Nc2ncn(-c3ncc(C)cc3Cl)n2)cc(C(F)(F)F)c1.Cc1cc(CCCNc2ccc(Cl)c(-c3ccccn3)c2)cc(C(F)(F)F)c1.

What is the InChIKey of N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide?

The InChIKey is RSZQNLQIZFVTJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClF3N2.C20H17ClN2O3.C17H13ClF3N5O.C17H16ClN5O2/c1-15-11-16(13-17(12-15)22(24,25)26)5-4-10-27-18-7-8-20(23)19(14-18)21-6-2-3-9-28-21;1-25-15-9-13(10-16(12-15)26-2)20(24)23-14-6-7-18(21)17(11-14)19-5-3-4-8-22-19;1-9-3-11(6-12(4-9)17(19,20)21)15(27)24-16-23-8-26(25-16)14-13(18)5-10(2)7-22-14;1-10-4-12(7-13(5-10)25-3)16(24)21-17-20-9-23(22-17)15-14(18)6-11(2)8-19-15/h2-3,6-9,11-14,27H,4-5,10H2,1H3;3-12H,1-2H3,(H,23,24);3-8H,1-2H3,(H,24,25,27);4-9H,1-3H3,(H,21,22,24).

What are the key properties of N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide?

N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide has a molecular weight of 1527.26 g/mol, XLogP of 18.84, 18 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methyl-5-(trifluoromethyl)benzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide is sourced from PubChem (CID 160720188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).