N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide

C23H18FN3O — CID 7777734

IUPACN-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C23H18FN3O/c1-16-12-13-18(24)14-21(16)25-23(28)20-15-27(19-10-6-3-7-11-19)26-22(20)17-8-4-2-5-9-17/h2-15H,1H3,(H,25,28)
InChIKeyXWABRKYIJKWEMB-UHFFFAOYSA-N
MW371.42 g/mol
LogP5.24
Rot. Bonds4

About N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide

N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide (PubChem CID 7777734) has the molecular formula C23H18FN3O and a molecular weight of 371.42 g/mol. Its IUPAC name is N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide
PubChem CID7777734
Molecular FormulaC23H18FN3O
Molecular Weight371.42 g/mol
Exact Mass371.14
IUPAC NameN-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C23H18FN3O/c1-16-12-13-18(24)14-21(16)25-23(28)20-15-27(19-10-6-3-7-11-19)26-22(20)17-8-4-2-5-9-17/h2-15H,1H3,(H,25,28)
InChIKeyXWABRKYIJKWEMB-UHFFFAOYSA-N
XLogP5.24
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.42
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-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-(2,5-dimethylphenyl)-1,3-diphenylpyrazole-4-carboxamide
CID 19281305
N-(5-fluoro-2-methylphenyl)-1-phenyl-3-thiophen-2-ylpyrazole-4-carboxamide
CID 4812792
N-(3-acetamido-4-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide
CID 55784527
N-(2,5-difluorophenyl)-3-(4-methoxyphenyl)-1-phenylpyrazole-4-carboxamide
CID 55344475
N-(2,5-dimethylphenyl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 8712640
3-(3-chlorophenyl)-N-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide
CID 154929741
N-(2-chlorophenyl)-3-(3,4-dimethylphenyl)-1-phenylpyrazole-4-carboxamide
CID 2412473
N-(5-fluoro-2-methylphenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide
CID 4799414
1,3-diphenyl-N-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
CID 19281225
3-(4-fluorophenyl)-N-(2-nitrophenyl)-1-phenylpyrazole-4-carboxamide
CID 4114034
N-(2-fluoro-5-methylphenyl)-3-(4-methoxyphenyl)-1-phenylpyrazole-4-carboxamide
CID 26881990
3-(4-fluorophenyl)-N',N'-dimethyl-1-phenylpyrazole-4-carbohydrazide
CID 9163796

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide?
The IUPAC name of N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide (CID 7777734) is N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide?
The canonical SMILES for N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide is Cc1ccc(F)cc1NC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1.
What is the InChIKey of N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide?
The InChIKey is XWABRKYIJKWEMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN3O/c1-16-12-13-18(24)14-21(16)25-23(28)20-15-27(19-10-6-3-7-11-19)26-22(20)17-8-4-2-5-9-17/h2-15H,1H3,(H,25,28).
What are the key properties of N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide?
N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide has a molecular weight of 371.42 g/mol, XLogP of 5.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methylphenyl)-1,3-diphenylpyrazole-4-carboxamide is sourced from PubChem (CID 7777734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).