3-hydroxy-N-phenylmethoxybutanamide

C11H15NO3 — CID 561070

IUPAC3-hydroxy-N-phenylmethoxybutanamide
SMILESCC(O)CC(=O)NOCc1ccccc1
InChIInChI=1S/C11H15NO3/c1-9(13)7-11(14)12-15-8-10-5-3-2-4-6-10/h2-6,9,13H,7-8H2,1H3,(H,12,14)
InChIKeyXCJSBIPLKYPTQI-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.01
Rot. Bonds5

About 3-hydroxy-N-phenylmethoxybutanamide

3-hydroxy-N-phenylmethoxybutanamide (PubChem CID 561070) has the molecular formula C11H15NO3 and a molecular weight of 209.25 g/mol. Its IUPAC name is 3-hydroxy-N-phenylmethoxybutanamide.

Molecular Properties

Compound Name3-hydroxy-N-phenylmethoxybutanamide
PubChem CID561070
Molecular FormulaC11H15NO3
Molecular Weight209.25 g/mol
Exact Mass209.11
IUPAC Name3-hydroxy-N-phenylmethoxybutanamide
SMILESCC(O)CC(=O)NOCc1ccccc1
InChIInChI=1S/C11H15NO3/c1-9(13)7-11(14)12-15-8-10-5-3-2-4-6-10/h2-6,9,13H,7-8H2,1H3,(H,12,14)
InChIKeyXCJSBIPLKYPTQI-UHFFFAOYSA-N
XLogP1.01
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-hydroxy-N-phenylmethoxybutanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-phenylmethoxybutanamide?
The IUPAC name of 3-hydroxy-N-phenylmethoxybutanamide (CID 561070) is 3-hydroxy-N-phenylmethoxybutanamide.
What is the SMILES notation for 3-hydroxy-N-phenylmethoxybutanamide?
The canonical SMILES for 3-hydroxy-N-phenylmethoxybutanamide is CC(O)CC(=O)NOCc1ccccc1.
What is the InChIKey of 3-hydroxy-N-phenylmethoxybutanamide?
The InChIKey is XCJSBIPLKYPTQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-9(13)7-11(14)12-15-8-10-5-3-2-4-6-10/h2-6,9,13H,7-8H2,1H3,(H,12,14).
What are the key properties of 3-hydroxy-N-phenylmethoxybutanamide?
3-hydroxy-N-phenylmethoxybutanamide has a molecular weight of 209.25 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-phenylmethoxybutanamide is sourced from PubChem (CID 561070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).