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

C20H19N3O — CID 11313151

IUPACN-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1cc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C20H19N3O/c1-14(2)20(24)23-18-13-17(15-9-5-3-6-10-15)21-19(22-18)16-11-7-4-8-12-16/h3-14H,1-2H3,(H,21,22,23,24)
InChIKeyONJOWWUQGQUDTK-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.41
Rot. Bonds4

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

N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide (PubChem CID 11313151) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide
PubChem CID11313151
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC NameN-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1cc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C20H19N3O/c1-14(2)20(24)23-18-13-17(15-9-5-3-6-10-15)21-19(22-18)16-11-7-4-8-12-16/h3-14H,1-2H3,(H,21,22,23,24)
InChIKeyONJOWWUQGQUDTK-UHFFFAOYSA-N
XLogP4.41
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide 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-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide?
The IUPAC name of N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide (CID 11313151) is N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide.
What is the SMILES notation for N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide?
The canonical SMILES for N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide is CC(C)C(=O)Nc1cc(-c2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide?
The InChIKey is ONJOWWUQGQUDTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c1-14(2)20(24)23-18-13-17(15-9-5-3-6-10-15)21-19(22-18)16-11-7-4-8-12-16/h3-14H,1-2H3,(H,21,22,23,24).
What are the key properties of N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide?
N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide has a molecular weight of 317.39 g/mol, XLogP of 4.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diphenylpyrimidin-4-yl)-2-methylpropanamide is sourced from PubChem (CID 11313151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).