N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide

C15H12N2O2 — CID 1084683

IUPACN-(2-phenyl-1,3-benzoxazol-6-yl)acetamide
SMILESCC(=O)Nc1ccc2nc(-c3ccccc3)oc2c1
InChIInChI=1S/C15H12N2O2/c1-10(18)16-12-7-8-13-14(9-12)19-15(17-13)11-5-3-2-4-6-11/h2-9H,1H3,(H,16,18)
InChIKeyHBFCXUKFPWQBNS-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.45
Rot. Bonds2

About N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide

N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide (PubChem CID 1084683) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide.

Molecular Properties

Compound NameN-(2-phenyl-1,3-benzoxazol-6-yl)acetamide
PubChem CID1084683
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC NameN-(2-phenyl-1,3-benzoxazol-6-yl)acetamide
SMILESCC(=O)Nc1ccc2nc(-c3ccccc3)oc2c1
InChIInChI=1S/C15H12N2O2/c1-10(18)16-12-7-8-13-14(9-12)19-15(17-13)11-5-3-2-4-6-11/h2-9H,1H3,(H,16,18)
InChIKeyHBFCXUKFPWQBNS-UHFFFAOYSA-N
XLogP3.45
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-phenyl-1,3-benzoxazol-6-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-phenyl-1,3-benzoxazol-6-yl)acetamide?
The IUPAC name of N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide (CID 1084683) is N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide.
What is the SMILES notation for N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide?
The canonical SMILES for N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide is CC(=O)Nc1ccc2nc(-c3ccccc3)oc2c1.
What is the InChIKey of N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide?
The InChIKey is HBFCXUKFPWQBNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-10(18)16-12-7-8-13-14(9-12)19-15(17-13)11-5-3-2-4-6-11/h2-9H,1H3,(H,16,18).
What are the key properties of N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide?
N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide has a molecular weight of 252.27 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenyl-1,3-benzoxazol-6-yl)acetamide is sourced from PubChem (CID 1084683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).