2-[(4-phenoxybenzoyl)amino]acetic acid

C15H13NO4 — CID 2404831

IUPAC2-[(4-phenoxybenzoyl)amino]acetic acid
SMILESO=C(O)CNC(=O)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C15H13NO4/c17-14(18)10-16-15(19)11-6-8-13(9-7-11)20-12-4-2-1-3-5-12/h1-9H,10H2,(H,16,19)(H,17,18)
InChIKeyRWPWRWSNTGJXQW-UHFFFAOYSA-N
MW271.27 g/mol
LogP2.29
Rot. Bonds5

About 2-[(4-phenoxybenzoyl)amino]acetic acid

2-[(4-phenoxybenzoyl)amino]acetic acid (PubChem CID 2404831) has the molecular formula C15H13NO4 and a molecular weight of 271.27 g/mol. Its IUPAC name is 2-[(4-phenoxybenzoyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(4-phenoxybenzoyl)amino]acetic acid
PubChem CID2404831
Molecular FormulaC15H13NO4
Molecular Weight271.27 g/mol
Exact Mass271.08
IUPAC Name2-[(4-phenoxybenzoyl)amino]acetic acid
SMILESO=C(O)CNC(=O)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C15H13NO4/c17-14(18)10-16-15(19)11-6-8-13(9-7-11)20-12-4-2-1-3-5-12/h1-9H,10H2,(H,16,19)(H,17,18)
InChIKeyRWPWRWSNTGJXQW-UHFFFAOYSA-N
XLogP2.29
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(4-phenoxybenzoyl)amino]acetic acid 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 2-[(4-phenoxybenzoyl)amino]acetic acid?
The IUPAC name of 2-[(4-phenoxybenzoyl)amino]acetic acid (CID 2404831) is 2-[(4-phenoxybenzoyl)amino]acetic acid.
What is the SMILES notation for 2-[(4-phenoxybenzoyl)amino]acetic acid?
The canonical SMILES for 2-[(4-phenoxybenzoyl)amino]acetic acid is O=C(O)CNC(=O)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 2-[(4-phenoxybenzoyl)amino]acetic acid?
The InChIKey is RWPWRWSNTGJXQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO4/c17-14(18)10-16-15(19)11-6-8-13(9-7-11)20-12-4-2-1-3-5-12/h1-9H,10H2,(H,16,19)(H,17,18).
What are the key properties of 2-[(4-phenoxybenzoyl)amino]acetic acid?
2-[(4-phenoxybenzoyl)amino]acetic acid has a molecular weight of 271.27 g/mol, XLogP of 2.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-phenoxybenzoyl)amino]acetic acid is sourced from PubChem (CID 2404831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).