(2R)-2-acetamido-2-phenylpropanoic acid

C11H13NO3 — CID 91535796

IUPAC(2R)-2-acetamido-2-phenylpropanoic acid
SMILESCC(=O)N[C@@](C)(C(=O)O)c1ccccc1
InChIInChI=1S/C11H13NO3/c1-8(13)12-11(2,10(14)15)9-6-4-3-5-7-9/h3-7H,1-2H3,(H,12,13)(H,14,15)/t11-/m1/s1
InChIKeyQZMOGBLDXPANBR-LLVKDONJSA-N
MW207.23 g/mol
LogP1.12
Rot. Bonds3

About (2R)-2-acetamido-2-phenylpropanoic acid

(2R)-2-acetamido-2-phenylpropanoic acid (PubChem CID 91535796) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is (2R)-2-acetamido-2-phenylpropanoic acid.

Molecular Properties

Compound Name(2R)-2-acetamido-2-phenylpropanoic acid
PubChem CID91535796
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name(2R)-2-acetamido-2-phenylpropanoic acid
SMILESCC(=O)N[C@@](C)(C(=O)O)c1ccccc1
InChIInChI=1S/C11H13NO3/c1-8(13)12-11(2,10(14)15)9-6-4-3-5-7-9/h3-7H,1-2H3,(H,12,13)(H,14,15)/t11-/m1/s1
InChIKeyQZMOGBLDXPANBR-LLVKDONJSA-N
XLogP1.12
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R)-2-acetamido-2-phenylpropanoic 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-acetamido-2-(3-hydroxyphenyl)propanoic acid
CID 63702146
(2S)-2-(carbamoylamino)-2-phenylpropanoic acid
CID 94456492
(2S)-2-benzamido-2-phenylpropanoic acid
CID 10967539
2-acetamido-2-(3,4-dimethylphenyl)propanoic acid
CID 63705027
2-(phenoxycarbonylamino)-2-phenylpropanoic acid
CID 62489572
2-[[2-(methylamino)acetyl]amino]-2-phenylpropanoic acid
CID 55078720
2-[(2-amino-3,3-dimethylbutanoyl)amino]-2-phenylpropanoic acid
CID 76944505
2-phenyl-2-(3,3,3-trifluoropropanoylamino)propanoic acid
CID 55078201
2-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]-2-phenylpropanoic acid
CID 115949251
(2S)-2-formamido-2-phenylpropanoic acid
CID 86615567
2-[(1-aminocyclopropanecarbonyl)amino]-2-phenylpropanoic acid
CID 65464716
2-[[2-(ethylamino)-2-methylpropanoyl]amino]-2-phenylpropanoic acid
CID 62834631

Frequently Asked Questions

What is the IUPAC name of (2R)-2-acetamido-2-phenylpropanoic acid?
The IUPAC name of (2R)-2-acetamido-2-phenylpropanoic acid (CID 91535796) is (2R)-2-acetamido-2-phenylpropanoic acid.
What is the SMILES notation for (2R)-2-acetamido-2-phenylpropanoic acid?
The canonical SMILES for (2R)-2-acetamido-2-phenylpropanoic acid is CC(=O)N[C@@](C)(C(=O)O)c1ccccc1.
What is the InChIKey of (2R)-2-acetamido-2-phenylpropanoic acid?
The InChIKey is QZMOGBLDXPANBR-LLVKDONJSA-N. The full InChI is InChI=1S/C11H13NO3/c1-8(13)12-11(2,10(14)15)9-6-4-3-5-7-9/h3-7H,1-2H3,(H,12,13)(H,14,15)/t11-/m1/s1.
What are the key properties of (2R)-2-acetamido-2-phenylpropanoic acid?
(2R)-2-acetamido-2-phenylpropanoic acid has a molecular weight of 207.23 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-acetamido-2-phenylpropanoic acid is sourced from PubChem (CID 91535796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).