N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide

C23H19N3O3 — CID 1420474

IUPACN-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide
SMILESCc1ccc(-c2nc3ccccc3c(=O)n2NC(=O)COc2ccccc2)cc1
InChIInChI=1S/C23H19N3O3/c1-16-11-13-17(14-12-16)22-24-20-10-6-5-9-19(20)23(28)26(22)25-21(27)15-29-18-7-3-2-4-8-18/h2-14H,15H2,1H3,(H,25,27)
InChIKeyFERNMATZANVAQK-UHFFFAOYSA-N
MW385.42 g/mol
LogP3.52
Rot. Bonds5

About N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide

N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide (PubChem CID 1420474) has the molecular formula C23H19N3O3 and a molecular weight of 385.42 g/mol. Its IUPAC name is N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide
PubChem CID1420474
Molecular FormulaC23H19N3O3
Molecular Weight385.42 g/mol
Exact Mass385.14
IUPAC NameN-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide
SMILESCc1ccc(-c2nc3ccccc3c(=O)n2NC(=O)COc2ccccc2)cc1
InChIInChI=1S/C23H19N3O3/c1-16-11-13-17(14-12-16)22-24-20-10-6-5-9-19(20)23(28)26(22)25-21(27)15-29-18-7-3-2-4-8-18/h2-14H,15H2,1H3,(H,25,27)
InChIKeyFERNMATZANVAQK-UHFFFAOYSA-N
XLogP3.52
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide 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-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide?
The IUPAC name of N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide (CID 1420474) is N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide.
What is the SMILES notation for N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide?
The canonical SMILES for N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide is Cc1ccc(-c2nc3ccccc3c(=O)n2NC(=O)COc2ccccc2)cc1.
What is the InChIKey of N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide?
The InChIKey is FERNMATZANVAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O3/c1-16-11-13-17(14-12-16)22-24-20-10-6-5-9-19(20)23(28)26(22)25-21(27)15-29-18-7-3-2-4-8-18/h2-14H,15H2,1H3,(H,25,27).
What are the key properties of N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide?
N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide has a molecular weight of 385.42 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]-2-phenoxyacetamide is sourced from PubChem (CID 1420474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).