2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide

C22H16ClN3O — CID 2818849

IUPAC2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide
SMILESO=C(Nc1cc(-c2ccccc2)nn1-c1ccccc1)c1ccccc1Cl
InChIInChI=1S/C22H16ClN3O/c23-19-14-8-7-13-18(19)22(27)24-21-15-20(16-9-3-1-4-10-16)25-26(21)17-11-5-2-6-12-17/h1-15H,(H,24,27)
InChIKeyIBNQBFUQMVEVQX-UHFFFAOYSA-N
MW373.84 g/mol
LogP5.45
Rot. Bonds4

About 2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide

2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide (PubChem CID 2818849) has the molecular formula C22H16ClN3O and a molecular weight of 373.84 g/mol. Its IUPAC name is 2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide
PubChem CID2818849
Molecular FormulaC22H16ClN3O
Molecular Weight373.84 g/mol
Exact Mass373.10
IUPAC Name2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide
SMILESO=C(Nc1cc(-c2ccccc2)nn1-c1ccccc1)c1ccccc1Cl
InChIInChI=1S/C22H16ClN3O/c23-19-14-8-7-13-18(19)22(27)24-21-15-20(16-9-3-1-4-10-16)25-26(21)17-11-5-2-6-12-17/h1-15H,(H,24,27)
InChIKeyIBNQBFUQMVEVQX-UHFFFAOYSA-N
XLogP5.45
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.84
LogP ≤ 55.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-chloro-N-(1,3-diphenylpyrazol-5-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

3-cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
CID 11245456
N-(1,3-diphenyl-1H-pyrazolo-5-yl)-4-nitrobenzamide
CID 11610682
N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
CID 4156919
4-cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
CID 11574130
N1-(3-phenyl-1H-pyrazol-5-yl)-4-chlorobenzamide
CID 339736
N-(1-methyl-3-phenylpyrazol-5-yl)benzamide
CID 2814962
2-chloro-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzamide
CID 5330983
5-{[5-(6-aminopyridin-2-yl)-2-chlorobenzene-1-carbonyl]amino}-1-phenyl-1H-pyrazole-3-carboxamide
CID 118456253
N-[1-(3-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]-2-methylbenzamide
CID 1508258
n-(1,3-Diphenyl-1h-pyrazol-5-yl)-4-fluorobenzamide
CID 11164167
3-nitro-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
CID 11625160
3-Chloro-N-(2,5-diphenyl-2H-pyrazol-3-yl)-benzamide
CID 11234162

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide?
The IUPAC name of 2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide (CID 2818849) is 2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide.
What is the SMILES notation for 2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide?
The canonical SMILES for 2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide is O=C(Nc1cc(-c2ccccc2)nn1-c1ccccc1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide?
The InChIKey is IBNQBFUQMVEVQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16ClN3O/c23-19-14-8-7-13-18(19)22(27)24-21-15-20(16-9-3-1-4-10-16)25-26(21)17-11-5-2-6-12-17/h1-15H,(H,24,27).
What are the key properties of 2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide?
2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide has a molecular weight of 373.84 g/mol, XLogP of 5.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1,3-diphenylpyrazol-5-yl)benzamide is sourced from PubChem (CID 2818849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).