2-(N-acetyl-4-hydroxyanilino)acetic acid

C10H11NO4 — CID 11063673

IUPAC2-(N-acetyl-4-hydroxyanilino)acetic acid
SMILESCC(=O)N(CC(=O)O)c1ccc(O)cc1
InChIInChI=1S/C10H11NO4/c1-7(12)11(6-10(14)15)8-2-4-9(13)5-3-8/h2-5,13H,6H2,1H3,(H,14,15)
InChIKeyXZFYOMHRTSFFJG-UHFFFAOYSA-N
MW209.20 g/mol
LogP0.83
Rot. Bonds3

About 2-(N-acetyl-4-hydroxyanilino)acetic acid

2-(N-acetyl-4-hydroxyanilino)acetic acid (PubChem CID 11063673) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is 2-(N-acetyl-4-hydroxyanilino)acetic acid.

Molecular Properties

Compound Name2-(N-acetyl-4-hydroxyanilino)acetic acid
PubChem CID11063673
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Name2-(N-acetyl-4-hydroxyanilino)acetic acid
SMILESCC(=O)N(CC(=O)O)c1ccc(O)cc1
InChIInChI=1S/C10H11NO4/c1-7(12)11(6-10(14)15)8-2-4-9(13)5-3-8/h2-5,13H,6H2,1H3,(H,14,15)
InChIKeyXZFYOMHRTSFFJG-UHFFFAOYSA-N
XLogP0.83
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-4-hydroxyanilino)acetic acid?
The IUPAC name of 2-(N-acetyl-4-hydroxyanilino)acetic acid (CID 11063673) is 2-(N-acetyl-4-hydroxyanilino)acetic acid.
What is the SMILES notation for 2-(N-acetyl-4-hydroxyanilino)acetic acid?
The canonical SMILES for 2-(N-acetyl-4-hydroxyanilino)acetic acid is CC(=O)N(CC(=O)O)c1ccc(O)cc1.
What is the InChIKey of 2-(N-acetyl-4-hydroxyanilino)acetic acid?
The InChIKey is XZFYOMHRTSFFJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c1-7(12)11(6-10(14)15)8-2-4-9(13)5-3-8/h2-5,13H,6H2,1H3,(H,14,15).
What are the key properties of 2-(N-acetyl-4-hydroxyanilino)acetic acid?
2-(N-acetyl-4-hydroxyanilino)acetic acid has a molecular weight of 209.20 g/mol, XLogP of 0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-4-hydroxyanilino)acetic acid is sourced from PubChem (CID 11063673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).