4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide

C16H13N3O2 — CID 135412754

IUPAC4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide
SMILESNC(=O)c1ccc(O)c(-c2cc(-c3ccccc3)n[nH]2)c1
InChIInChI=1S/C16H13N3O2/c17-16(21)11-6-7-15(20)12(8-11)14-9-13(18-19-14)10-4-2-1-3-5-10/h1-9,20H,(H2,17,21)(H,18,19)
InChIKeyALRPJRVYYVCJLM-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.55
Rot. Bonds3

About 4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide

4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide (PubChem CID 135412754) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide.

Molecular Properties

Compound Name4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide
PubChem CID135412754
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide
SMILESNC(=O)c1ccc(O)c(-c2cc(-c3ccccc3)n[nH]2)c1
InChIInChI=1S/C16H13N3O2/c17-16(21)11-6-7-15(20)12(8-11)14-9-13(18-19-14)10-4-2-1-3-5-10/h1-9,20H,(H2,17,21)(H,18,19)
InChIKeyALRPJRVYYVCJLM-UHFFFAOYSA-N
XLogP2.55
TPSA92.00 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-hydroxy-3-(3-phenyl-1H-pyrazol-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

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide?
The IUPAC name of 4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide (CID 135412754) is 4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide.
What is the SMILES notation for 4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide?
The canonical SMILES for 4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide is NC(=O)c1ccc(O)c(-c2cc(-c3ccccc3)n[nH]2)c1.
What is the InChIKey of 4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide?
The InChIKey is ALRPJRVYYVCJLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c17-16(21)11-6-7-15(20)12(8-11)14-9-13(18-19-14)10-4-2-1-3-5-10/h1-9,20H,(H2,17,21)(H,18,19).
What are the key properties of 4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide?
4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide has a molecular weight of 279.30 g/mol, XLogP of 2.55, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-(3-phenyl-1H-pyrazol-5-yl)benzamide is sourced from PubChem (CID 135412754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).