2-(2-amino-6-phenylphenyl)acetic acid

C14H13NO2 — CID 13048602

IUPAC2-(2-amino-6-phenylphenyl)acetic acid
SMILESNc1cccc(-c2ccccc2)c1CC(=O)O
InChIInChI=1S/C14H13NO2/c15-13-8-4-7-11(12(13)9-14(16)17)10-5-2-1-3-6-10/h1-8H,9,15H2,(H,16,17)
InChIKeyZEQFGZICFALZOB-UHFFFAOYSA-N
MW227.26 g/mol
LogP2.56
Rot. Bonds3

About 2-(2-amino-6-phenylphenyl)acetic acid

2-(2-amino-6-phenylphenyl)acetic acid (PubChem CID 13048602) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is 2-(2-amino-6-phenylphenyl)acetic acid.

Molecular Properties

Compound Name2-(2-amino-6-phenylphenyl)acetic acid
PubChem CID13048602
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC Name2-(2-amino-6-phenylphenyl)acetic acid
SMILESNc1cccc(-c2ccccc2)c1CC(=O)O
InChIInChI=1S/C14H13NO2/c15-13-8-4-7-11(12(13)9-14(16)17)10-5-2-1-3-6-10/h1-8H,9,15H2,(H,16,17)
InChIKeyZEQFGZICFALZOB-UHFFFAOYSA-N
XLogP2.56
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-(2-amino-6-phenylphenyl)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-(2-amino-6-phenylphenyl)acetic acid?
The IUPAC name of 2-(2-amino-6-phenylphenyl)acetic acid (CID 13048602) is 2-(2-amino-6-phenylphenyl)acetic acid.
What is the SMILES notation for 2-(2-amino-6-phenylphenyl)acetic acid?
The canonical SMILES for 2-(2-amino-6-phenylphenyl)acetic acid is Nc1cccc(-c2ccccc2)c1CC(=O)O.
What is the InChIKey of 2-(2-amino-6-phenylphenyl)acetic acid?
The InChIKey is ZEQFGZICFALZOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c15-13-8-4-7-11(12(13)9-14(16)17)10-5-2-1-3-6-10/h1-8H,9,15H2,(H,16,17).
What are the key properties of 2-(2-amino-6-phenylphenyl)acetic acid?
2-(2-amino-6-phenylphenyl)acetic acid has a molecular weight of 227.26 g/mol, XLogP of 2.56, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-6-phenylphenyl)acetic acid is sourced from PubChem (CID 13048602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).