2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride

C48H35Cl5F12N14O4 — CID 158359733

About 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride

2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride (PubChem CID 158359733) has the molecular formula C48H35Cl5F12N14O4 and a molecular weight of 1277.14 g/mol. Its IUPAC name is 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride.

Molecular Properties

• Compound Name: 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride
• PubChem CID: 158359733
• Molecular Formula: C48H35Cl5F12N14O4
• Molecular Weight: 1277.14 g/mol
• Exact Mass: 1274.12
• IUPAC Name: 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride
• SMILES: CNC(=O)c1cc(Cl)cc(C)c1N.CNC(=O)c1cc(Cl)cc(C)c1NC(=O)c1cc(Cn2nc(C(F)(F)F)cc2C(F)(F)F)nn1-c1ncccc1Cl.O=C(Cl)c1cc(Cn2nc(C(F)(F)F)cc2C(F)(F)F)nn1-c1ncccc1Cl
• InChI: InChI=1S/C24H17Cl2F6N7O2.C15H7Cl2F6N5O.C9H11ClN2O/c1-11-6-12(25)7-14(21(40)33-2)19(11)35-22(41)16-8-13(36-39(16)20-15(26)4-3-5-34-20)10-38-18(24(30,31)32)9-17(37-38)23(27,28)29;16-8-2-1-3-24-13(8)28-9(12(17)29)4-7(25-28)6-27-11(15(21,22)23)5-10(26-27)14(18,19)20;1-5-3-6(10)4-7(8(5)11)9(13)12-2/h3-9H,10H2,1-2H3,(H,33,40)(H,35,41);1-5H,6H2;3-4H,11H2,1-2H3,(H,12,13)
• InChIKey: GTHZMVBLSZRSPX-UHFFFAOYSA-N
• XLogP: 11.95
• TPSA: 227.45 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 15
• Rotatable Bonds: 11
• Heavy Atoms: 83
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1277.14
LogP ≤ 5	11.95
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride?

The IUPAC name of 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride (CID 158359733) is 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride.

What is the SMILES notation for 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride?

The canonical SMILES for 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride is CNC(=O)c1cc(Cl)cc(C)c1N.CNC(=O)c1cc(Cl)cc(C)c1NC(=O)c1cc(Cn2nc(C(F)(F)F)cc2C(F)(F)F)nn1-c1ncccc1Cl.O=C(Cl)c1cc(Cn2nc(C(F)(F)F)cc2C(F)(F)F)nn1-c1ncccc1Cl.

What is the InChIKey of 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride?

The InChIKey is GTHZMVBLSZRSPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17Cl2F6N7O2.C15H7Cl2F6N5O.C9H11ClN2O/c1-11-6-12(25)7-14(21(40)33-2)19(11)35-22(41)16-8-13(36-39(16)20-15(26)4-3-5-34-20)10-38-18(24(30,31)32)9-17(37-38)23(27,28)29;16-8-2-1-3-24-13(8)28-9(12(17)29)4-7(25-28)6-27-11(15(21,22)23)5-10(26-27)14(18,19)20;1-5-3-6(10)4-7(8(5)11)9(13)12-2/h3-9H,10H2,1-2H3,(H,33,40)(H,35,41);1-5H,6H2;3-4H,11H2,1-2H3,(H,12,13).

What are the key properties of 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride?

2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride has a molecular weight of 1277.14 g/mol, XLogP of 11.95, 11 rotatable bonds, 4 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-5-chloro-N,3-dimethylbenzamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide;3-[[3,5-bis(trifluoromethyl)pyrazol-1-yl]methyl]-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl chloride is sourced from PubChem (CID 158359733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).