2-(2-amino-4-phenylphenyl)acetic acid

C14H13NO2 — CID 12909825

IUPAC2-(2-amino-4-phenylphenyl)acetic acid
SMILESNc1cc(-c2ccccc2)ccc1CC(=O)O
InChIInChI=1S/C14H13NO2/c15-13-8-11(10-4-2-1-3-5-10)6-7-12(13)9-14(16)17/h1-8H,9,15H2,(H,16,17)
InChIKeySQBDSCWLHSMSHG-UHFFFAOYSA-N
MW227.26 g/mol
LogP2.56
Rot. Bonds3

About 2-(2-amino-4-phenylphenyl)acetic acid

2-(2-amino-4-phenylphenyl)acetic acid (PubChem CID 12909825) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is 2-(2-amino-4-phenylphenyl)acetic acid.

Molecular Properties

Compound Name2-(2-amino-4-phenylphenyl)acetic acid
PubChem CID12909825
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC Name2-(2-amino-4-phenylphenyl)acetic acid
SMILESNc1cc(-c2ccccc2)ccc1CC(=O)O
InChIInChI=1S/C14H13NO2/c15-13-8-11(10-4-2-1-3-5-10)6-7-12(13)9-14(16)17/h1-8H,9,15H2,(H,16,17)
InChIKeySQBDSCWLHSMSHG-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'}

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Related Compounds

4-Aminophenylacetic acid
CID 14533
3-Amino-4-methylbenzoic acid
CID 75568
4-Aminohydratropic acid
CID 43026
2-Anilinophenylacetic acid
CID 854057
2-(2-(2-Fluorophenylamino)phenyl)acetic acid
CID 18546352
2-(4-Aminophenyl)butanoic acid
CID 34655
3-(3-Aminophenyl)propionic acid
CID 2735406
7-[4-[(4-Aminophenyl)methyl]phenyl]heptanoic acid
CID 10244965
3-Biphenylacetic acid, 5-amino-
CID 53372
2-(4-Aminophenyl)-2-phenylacetic acid
CID 346835
2-(3-Aminophenyl)acetic acid hydrochloride
CID 45263726
(3-Aminophenyl)acetic acid
CID 571807

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-phenylphenyl)acetic acid?
The IUPAC name of 2-(2-amino-4-phenylphenyl)acetic acid (CID 12909825) is 2-(2-amino-4-phenylphenyl)acetic acid.
What is the SMILES notation for 2-(2-amino-4-phenylphenyl)acetic acid?
The canonical SMILES for 2-(2-amino-4-phenylphenyl)acetic acid is Nc1cc(-c2ccccc2)ccc1CC(=O)O.
What is the InChIKey of 2-(2-amino-4-phenylphenyl)acetic acid?
The InChIKey is SQBDSCWLHSMSHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c15-13-8-11(10-4-2-1-3-5-10)6-7-12(13)9-14(16)17/h1-8H,9,15H2,(H,16,17).
What are the key properties of 2-(2-amino-4-phenylphenyl)acetic acid?
2-(2-amino-4-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-4-phenylphenyl)acetic acid is sourced from PubChem (CID 12909825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).