3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide

C23H18ClN3O — CID 154929741

IUPAC3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide
SMILESCc1ccccc1NC(=O)c1cn(-c2ccccc2)nc1-c1cccc(Cl)c1
InChIInChI=1S/C23H18ClN3O/c1-16-8-5-6-13-21(16)25-23(28)20-15-27(19-11-3-2-4-12-19)26-22(20)17-9-7-10-18(24)14-17/h2-15H,1H3,(H,25,28)
InChIKeyNPYRWGYSMHFWQH-UHFFFAOYSA-N
MW387.87 g/mol
LogP5.75
Rot. Bonds4

About 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide

3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide (PubChem CID 154929741) has the molecular formula C23H18ClN3O and a molecular weight of 387.87 g/mol. Its IUPAC name is 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide.

Molecular Properties

Compound Name3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide
PubChem CID154929741
Molecular FormulaC23H18ClN3O
Molecular Weight387.87 g/mol
Exact Mass387.11
IUPAC Name3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide
SMILESCc1ccccc1NC(=O)c1cn(-c2ccccc2)nc1-c1cccc(Cl)c1
InChIInChI=1S/C23H18ClN3O/c1-16-8-5-6-13-21(16)25-23(28)20-15-27(19-11-3-2-4-12-19)26-22(20)17-9-7-10-18(24)14-17/h2-15H,1H3,(H,25,28)
InChIKeyNPYRWGYSMHFWQH-UHFFFAOYSA-N
XLogP5.75
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.87
LogP ≤ 55.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-chlorophenyl)-3-(3,4-dimethylphenyl)-1-phenylpyrazole-4-carboxamide
CID 2412473
N-(2,5-dimethylphenyl)-1,3-diphenylpyrazole-4-carboxamide
CID 19281305
4-[[3-(3-chlorophenyl)-1-phenylpyrazole-4-carbonyl]amino]benzoic acid
CID 1287582
N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide
CID 7777734
N-(2,3-dimethylphenyl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 8714286
N-(4-acetamido-2-chlorophenyl)-3-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide
CID 56580220
N-(3-acetamido-4-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide
CID 55784527
N-(3-chlorophenyl)-1-phenyl-3-pyridin-4-ylpyrazole-4-carboxamide
CID 166184461
1,3-diphenyl-N-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
CID 19281225
N-(2,5-dimethylphenyl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 8712640
N-(5-chloro-2,4-dimethoxyphenyl)-1,3-diphenylpyrazole-4-carboxamide
CID 26210602
N-[1-[(3-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-1,3-diphenylpyrazole-4-carboxamide
CID 19281407

Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide?
The IUPAC name of 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide (CID 154929741) is 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide.
What is the SMILES notation for 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide?
The canonical SMILES for 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide is Cc1ccccc1NC(=O)c1cn(-c2ccccc2)nc1-c1cccc(Cl)c1.
What is the InChIKey of 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide?
The InChIKey is NPYRWGYSMHFWQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18ClN3O/c1-16-8-5-6-13-21(16)25-23(28)20-15-27(19-11-3-2-4-12-19)26-22(20)17-9-7-10-18(24)14-17/h2-15H,1H3,(H,25,28).
What are the key properties of 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide?
3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide has a molecular weight of 387.87 g/mol, XLogP of 5.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide is sourced from PubChem (CID 154929741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).