N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

C16H14N2O3 — CID 893886

IUPACN-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCc1ccccc1NC(=O)Cn1c(=O)oc2ccccc21
InChIInChI=1S/C16H14N2O3/c1-11-6-2-3-7-12(11)17-15(19)10-18-13-8-4-5-9-14(13)21-16(18)20/h2-9H,10H2,1H3,(H,17,19)
InChIKeyQCYXLWQJKJDYFL-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.54
Rot. Bonds3

About N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (PubChem CID 893886) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
PubChem CID893886
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC NameN-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCc1ccccc1NC(=O)Cn1c(=O)oc2ccccc21
InChIInChI=1S/C16H14N2O3/c1-11-6-2-3-7-12(11)17-15(19)10-18-13-8-4-5-9-14(13)21-16(18)20/h2-9H,10H2,1H3,(H,17,19)
InChIKeyQCYXLWQJKJDYFL-UHFFFAOYSA-N
XLogP2.54
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide 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-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The IUPAC name of N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (CID 893886) is N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.
What is the SMILES notation for N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The canonical SMILES for N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is Cc1ccccc1NC(=O)Cn1c(=O)oc2ccccc21.
What is the InChIKey of N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The InChIKey is QCYXLWQJKJDYFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-11-6-2-3-7-12(11)17-15(19)10-18-13-8-4-5-9-14(13)21-16(18)20/h2-9H,10H2,1H3,(H,17,19).
What are the key properties of N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide has a molecular weight of 282.30 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is sourced from PubChem (CID 893886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).