N-benzhydryl-4-(hydroxymethyl)benzamide

C21H19NO2 — CID 2451102

IUPACN-benzhydryl-4-(hydroxymethyl)benzamide
SMILESO=C(NC(c1ccccc1)c1ccccc1)c1ccc(CO)cc1
InChIInChI=1S/C21H19NO2/c23-15-16-11-13-19(14-12-16)21(24)22-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14,20,23H,15H2,(H,22,24)
InChIKeyISBPLZPUISTJPL-UHFFFAOYSA-N
MW317.39 g/mol
LogP3.70
Rot. Bonds5

About N-benzhydryl-4-(hydroxymethyl)benzamide

N-benzhydryl-4-(hydroxymethyl)benzamide (PubChem CID 2451102) has the molecular formula C21H19NO2 and a molecular weight of 317.39 g/mol. Its IUPAC name is N-benzhydryl-4-(hydroxymethyl)benzamide.

Molecular Properties

Compound NameN-benzhydryl-4-(hydroxymethyl)benzamide
PubChem CID2451102
Molecular FormulaC21H19NO2
Molecular Weight317.39 g/mol
Exact Mass317.14
IUPAC NameN-benzhydryl-4-(hydroxymethyl)benzamide
SMILESO=C(NC(c1ccccc1)c1ccccc1)c1ccc(CO)cc1
InChIInChI=1S/C21H19NO2/c23-15-16-11-13-19(14-12-16)21(24)22-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14,20,23H,15H2,(H,22,24)
InChIKeyISBPLZPUISTJPL-UHFFFAOYSA-N
XLogP3.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-benzhydryl-4-(hydroxymethyl)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 N-benzhydryl-4-(hydroxymethyl)benzamide?
The IUPAC name of N-benzhydryl-4-(hydroxymethyl)benzamide (CID 2451102) is N-benzhydryl-4-(hydroxymethyl)benzamide.
What is the SMILES notation for N-benzhydryl-4-(hydroxymethyl)benzamide?
The canonical SMILES for N-benzhydryl-4-(hydroxymethyl)benzamide is O=C(NC(c1ccccc1)c1ccccc1)c1ccc(CO)cc1.
What is the InChIKey of N-benzhydryl-4-(hydroxymethyl)benzamide?
The InChIKey is ISBPLZPUISTJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2/c23-15-16-11-13-19(14-12-16)21(24)22-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14,20,23H,15H2,(H,22,24).
What are the key properties of N-benzhydryl-4-(hydroxymethyl)benzamide?
N-benzhydryl-4-(hydroxymethyl)benzamide has a molecular weight of 317.39 g/mol, XLogP of 3.70, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-4-(hydroxymethyl)benzamide is sourced from PubChem (CID 2451102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).