2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide

C19H19N3O — CID 19401906

IUPAC2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide
SMILESCc1ccc(Cn2cc(NC(=O)c3ccccc3C)cn2)cc1
InChIInChI=1S/C19H19N3O/c1-14-7-9-16(10-8-14)12-22-13-17(11-20-22)21-19(23)18-6-4-3-5-15(18)2/h3-11,13H,12H2,1-2H3,(H,21,23)
InChIKeyZKFCKSBGRPJVPE-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.80
Rot. Bonds4

About 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide

2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide (PubChem CID 19401906) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide
PubChem CID19401906
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide
SMILESCc1ccc(Cn2cc(NC(=O)c3ccccc3C)cn2)cc1
InChIInChI=1S/C19H19N3O/c1-14-7-9-16(10-8-14)12-22-13-17(11-20-22)21-19(23)18-6-4-3-5-15(18)2/h3-11,13H,12H2,1-2H3,(H,21,23)
InChIKeyZKFCKSBGRPJVPE-UHFFFAOYSA-N
XLogP3.80
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide 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

2,5-dimethyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide
CID 19401831
2-(4-chlorobenzoyl)-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide
CID 19401842
N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-2-methylbenzamide
CID 19397814
N-(1-ethylpyrazol-4-yl)-2-methylbenzamide
CID 51078638
N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-2,5-dimethylbenzamide
CID 19407730
N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-2,4-dimethylbenzamide
CID 19404033
2,5-dimethyl-N-[1-[(3-methylphenyl)methyl]pyrazol-4-yl]benzamide
CID 19336310
N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methylbenzamide
CID 58409595
2-fluoro-N-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]benzamide
CID 17088846
5-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]thiophene-2-carboxamide
CID 35277254
2-chloro-N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]benzamide
CID 19340031
N-(1-benzylpyrazol-4-yl)-5-(diethylsulfamoyl)-2-methylbenzamide
CID 60552677

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide?
The IUPAC name of 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide (CID 19401906) is 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide.
What is the SMILES notation for 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide?
The canonical SMILES for 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide is Cc1ccc(Cn2cc(NC(=O)c3ccccc3C)cn2)cc1.
What is the InChIKey of 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide?
The InChIKey is ZKFCKSBGRPJVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-14-7-9-16(10-8-14)12-22-13-17(11-20-22)21-19(23)18-6-4-3-5-15(18)2/h3-11,13H,12H2,1-2H3,(H,21,23).
What are the key properties of 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide?
2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide has a molecular weight of 305.38 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide is sourced from PubChem (CID 19401906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).