N-(4,6-diphenylpyrimidin-2-yl)benzamide

C23H17N3O — CID 11314132

IUPACN-(4,6-diphenylpyrimidin-2-yl)benzamide
SMILESO=C(Nc1nc(-c2ccccc2)cc(-c2ccccc2)n1)c1ccccc1
InChIInChI=1S/C23H17N3O/c27-22(19-14-8-3-9-15-19)26-23-24-20(17-10-4-1-5-11-17)16-21(25-23)18-12-6-2-7-13-18/h1-16H,(H,24,25,26,27)
InChIKeyYAAODHHMHPMCPL-UHFFFAOYSA-N
MW351.41 g/mol
LogP5.06
Rot. Bonds4

About N-(4,6-diphenylpyrimidin-2-yl)benzamide

N-(4,6-diphenylpyrimidin-2-yl)benzamide (PubChem CID 11314132) has the molecular formula C23H17N3O and a molecular weight of 351.41 g/mol. Its IUPAC name is N-(4,6-diphenylpyrimidin-2-yl)benzamide.

Molecular Properties

Compound NameN-(4,6-diphenylpyrimidin-2-yl)benzamide
PubChem CID11314132
Molecular FormulaC23H17N3O
Molecular Weight351.41 g/mol
Exact Mass351.14
IUPAC NameN-(4,6-diphenylpyrimidin-2-yl)benzamide
SMILESO=C(Nc1nc(-c2ccccc2)cc(-c2ccccc2)n1)c1ccccc1
InChIInChI=1S/C23H17N3O/c27-22(19-14-8-3-9-15-19)26-23-24-20(17-10-4-1-5-11-17)16-21(25-23)18-12-6-2-7-13-18/h1-16H,(H,24,25,26,27)
InChIKeyYAAODHHMHPMCPL-UHFFFAOYSA-N
XLogP5.06
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.41
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4,6-diphenylpyrimidin-2-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 N-(4,6-diphenylpyrimidin-2-yl)benzamide?
The IUPAC name of N-(4,6-diphenylpyrimidin-2-yl)benzamide (CID 11314132) is N-(4,6-diphenylpyrimidin-2-yl)benzamide.
What is the SMILES notation for N-(4,6-diphenylpyrimidin-2-yl)benzamide?
The canonical SMILES for N-(4,6-diphenylpyrimidin-2-yl)benzamide is O=C(Nc1nc(-c2ccccc2)cc(-c2ccccc2)n1)c1ccccc1.
What is the InChIKey of N-(4,6-diphenylpyrimidin-2-yl)benzamide?
The InChIKey is YAAODHHMHPMCPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3O/c27-22(19-14-8-3-9-15-19)26-23-24-20(17-10-4-1-5-11-17)16-21(25-23)18-12-6-2-7-13-18/h1-16H,(H,24,25,26,27).
What are the key properties of N-(4,6-diphenylpyrimidin-2-yl)benzamide?
N-(4,6-diphenylpyrimidin-2-yl)benzamide has a molecular weight of 351.41 g/mol, XLogP of 5.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-diphenylpyrimidin-2-yl)benzamide is sourced from PubChem (CID 11314132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).