2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid

C15H14N2O3 — CID 61157364

IUPAC2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid
SMILESN[C@@H](C(=O)Nc1ccccc1C(=O)O)c1ccccc1
InChIInChI=1S/C15H14N2O3/c16-13(10-6-2-1-3-7-10)14(18)17-12-9-5-4-8-11(12)15(19)20/h1-9,13H,16H2,(H,17,18)(H,19,20)/t13-/m1/s1
InChIKeyGRENGBCVOXNKGK-CYBMUJFWSA-N
MW270.29 g/mol
LogP2.02
Rot. Bonds4

About 2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid

2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid (PubChem CID 61157364) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid.

Molecular Properties

Compound Name2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid
PubChem CID61157364
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid
SMILESN[C@@H](C(=O)Nc1ccccc1C(=O)O)c1ccccc1
InChIInChI=1S/C15H14N2O3/c16-13(10-6-2-1-3-7-10)14(18)17-12-9-5-4-8-11(12)15(19)20/h1-9,13H,16H2,(H,17,18)(H,19,20)/t13-/m1/s1
InChIKeyGRENGBCVOXNKGK-CYBMUJFWSA-N
XLogP2.02
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-amino-2-(4-methylphenyl)acetyl]amino]benzoic acid
CID 106312235
(2S)-2-amino-N-[2-(methoxymethyl)phenyl]-2-phenylacetamide
CID 104897233
2-amino-N-(2,3-dimethylphenyl)-2-phenylacetamide
CID 24694954
2-[(2,4-diamino-4-oxobutanoyl)amino]benzoic acid
CID 61157183
2-amino-N-(2-tert-butylphenyl)-2-phenylacetamide
CID 43702622
2-amino-N-(2,3-difluorophenyl)-2-phenylacetamide
CID 61077017
2-amino-N-(3-chloro-2-fluorophenyl)-2-phenylacetamide
CID 43123024
5-[[(2R)-2-amino-2-phenylacetyl]amino]-2-bromobenzoic acid
CID 115296327
2-[[3,3,3-trifluoro-2-(trifluoromethyl)propanoyl]amino]benzoic acid
CID 589696
(2S)-2-amino-N-(2-morpholin-4-ylphenyl)-2-phenylacetamide
CID 22691745
(2S)-2-amino-N-(2-ethoxyphenyl)-2-phenylacetamide
CID 22691717
4-[[(2S)-2-amino-2-phenylacetyl]amino]-2-methylbenzoic acid
CID 103869544

Frequently Asked Questions

What is the IUPAC name of 2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid?
The IUPAC name of 2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid (CID 61157364) is 2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid.
What is the SMILES notation for 2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid?
The canonical SMILES for 2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid is N[C@@H](C(=O)Nc1ccccc1C(=O)O)c1ccccc1.
What is the InChIKey of 2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid?
The InChIKey is GRENGBCVOXNKGK-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H14N2O3/c16-13(10-6-2-1-3-7-10)14(18)17-12-9-5-4-8-11(12)15(19)20/h1-9,13H,16H2,(H,17,18)(H,19,20)/t13-/m1/s1.
What are the key properties of 2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid?
2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid has a molecular weight of 270.29 g/mol, XLogP of 2.02, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-2-amino-2-phenylacetyl]amino]benzoic acid is sourced from PubChem (CID 61157364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).