(2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid

C12H14N2O5 — CID 54991568

IUPAC(2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid
SMILESC[C@@H](NC(=O)COc1ccccc1C(N)=O)C(=O)O
InChIInChI=1S/C12H14N2O5/c1-7(12(17)18)14-10(15)6-19-9-5-3-2-4-8(9)11(13)16/h2-5,7H,6H2,1H3,(H2,13,16)(H,14,15)(H,17,18)/t7-/m1/s1
InChIKeyPSFRXTMVHBOICB-SSDOTTSWSA-N
MW266.25 g/mol
LogP-0.25
Rot. Bonds6

About (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid

(2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid (PubChem CID 54991568) has the molecular formula C12H14N2O5 and a molecular weight of 266.25 g/mol. Its IUPAC name is (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid.

Molecular Properties

Compound Name(2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid
PubChem CID54991568
Molecular FormulaC12H14N2O5
Molecular Weight266.25 g/mol
Exact Mass266.09
IUPAC Name(2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid
SMILESC[C@@H](NC(=O)COc1ccccc1C(N)=O)C(=O)O
InChIInChI=1S/C12H14N2O5/c1-7(12(17)18)14-10(15)6-19-9-5-3-2-4-8(9)11(13)16/h2-5,7H,6H2,1H3,(H2,13,16)(H,14,15)(H,17,18)/t7-/m1/s1
InChIKeyPSFRXTMVHBOICB-SSDOTTSWSA-N
XLogP-0.25
TPSA118.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.25
LogP ≤ 5-0.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-(methylamino)-2-oxoethoxy]benzamide
CID 2578374
2-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethoxy]benzamide
CID 8866061
(2S)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoic acid
CID 746811
2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide
CID 43426354
2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide
CID 7199656
2-[2-[[(1R)-1-(2-bromophenyl)ethyl]amino]-2-oxoethoxy]benzamide
CID 9090585
2-[[2-(2-prop-2-enoxyphenoxy)acetyl]amino]propanoic acid
CID 82043574
2-(2-carbamothioylphenoxy)-N-(3-methylbutan-2-yl)acetamide
CID 43131454
methyl (2R)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoate
CID 113257879
2-[2-[[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-2-oxoethoxy]benzamide
CID 7283926
(2S)-2-[[2-(2,3-dimethylphenoxy)acetyl]amino]propanoic acid
CID 9156872
2-[2-[[(S)-(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethoxy]benzamide
CID 8851691

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid?
The IUPAC name of (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid (CID 54991568) is (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid.
What is the SMILES notation for (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid?
The canonical SMILES for (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid is C[C@@H](NC(=O)COc1ccccc1C(N)=O)C(=O)O.
What is the InChIKey of (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid?
The InChIKey is PSFRXTMVHBOICB-SSDOTTSWSA-N. The full InChI is InChI=1S/C12H14N2O5/c1-7(12(17)18)14-10(15)6-19-9-5-3-2-4-8(9)11(13)16/h2-5,7H,6H2,1H3,(H2,13,16)(H,14,15)(H,17,18)/t7-/m1/s1.
What are the key properties of (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid?
(2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid has a molecular weight of 266.25 g/mol, XLogP of -0.25, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid is sourced from PubChem (CID 54991568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).