2-acetamido-2-hydroxy-2-phenylacetic acid

C10H11NO4 — CID 151383557

IUPAC2-acetamido-2-hydroxy-2-phenylacetic acid
SMILESCC(=O)NC(O)(C(=O)O)c1ccccc1
InChIInChI=1S/C10H11NO4/c1-7(12)11-10(15,9(13)14)8-5-3-2-4-6-8/h2-6,15H,1H3,(H,11,12)(H,13,14)
InChIKeyOSXUAGMRHPFBEM-UHFFFAOYSA-N
MW209.20 g/mol
LogP0.05
Rot. Bonds3

About 2-acetamido-2-hydroxy-2-phenylacetic acid

2-acetamido-2-hydroxy-2-phenylacetic acid (PubChem CID 151383557) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is 2-acetamido-2-hydroxy-2-phenylacetic acid.

Molecular Properties

Compound Name2-acetamido-2-hydroxy-2-phenylacetic acid
PubChem CID151383557
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Name2-acetamido-2-hydroxy-2-phenylacetic acid
SMILESCC(=O)NC(O)(C(=O)O)c1ccccc1
InChIInChI=1S/C10H11NO4/c1-7(12)11-10(15,9(13)14)8-5-3-2-4-6-8/h2-6,15H,1H3,(H,11,12)(H,13,14)
InChIKeyOSXUAGMRHPFBEM-UHFFFAOYSA-N
XLogP0.05
TPSA86.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-Acetyl-DL-phenylglycine
CID 85935
(S)-2-(Boc-amino)-2-phenylpropanoic acid
CID 13678038
(S)-2-Acetamido-2-phenylacetic acid
CID 726854
2-(((Tert-butoxy)carbonyl)amino)-2-phenylpropanoic acid
CID 13678037
2-{[(Tert-butoxy)carbonyl]amino}-2-phenylbutanoic acid
CID 54271493
(2R)-2-(((tert-butoxy)carbonyl)amino)-2-phenylpropanoic acid
CID 57183565
(R)-2-Acetamido-2-phenylacetic acid
CID 726856
2-Amino-2-hydroxy-2-phenylacetic acid
CID 19376190
2-[2-[(Carboxy-hydroxy-phenylmethyl)amino]ethylamino]-2-hydroxy-2-phenylacetic acid
CID 66695132
(2R)-2-Acetamido-2-phenylpropanoic acid
CID 91535796
Glyphol
CID 129819064
N-acetyl-d-aminophenylacetic acid
CID 129820174

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-2-hydroxy-2-phenylacetic acid?
The IUPAC name of 2-acetamido-2-hydroxy-2-phenylacetic acid (CID 151383557) is 2-acetamido-2-hydroxy-2-phenylacetic acid.
What is the SMILES notation for 2-acetamido-2-hydroxy-2-phenylacetic acid?
The canonical SMILES for 2-acetamido-2-hydroxy-2-phenylacetic acid is CC(=O)NC(O)(C(=O)O)c1ccccc1.
What is the InChIKey of 2-acetamido-2-hydroxy-2-phenylacetic acid?
The InChIKey is OSXUAGMRHPFBEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c1-7(12)11-10(15,9(13)14)8-5-3-2-4-6-8/h2-6,15H,1H3,(H,11,12)(H,13,14).
What are the key properties of 2-acetamido-2-hydroxy-2-phenylacetic acid?
2-acetamido-2-hydroxy-2-phenylacetic acid has a molecular weight of 209.20 g/mol, XLogP of 0.05, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-2-hydroxy-2-phenylacetic acid is sourced from PubChem (CID 151383557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).