4-hydroxy-4-(2-methylphenyl)butanamide

C11H15NO2 — CID 82111988

IUPAC4-hydroxy-4-(2-methylphenyl)butanamide
SMILESCc1ccccc1C(O)CCC(N)=O
InChIInChI=1S/C11H15NO2/c1-8-4-2-3-5-9(8)10(13)6-7-11(12)14/h2-5,10,13H,6-7H2,1H3,(H2,12,14)
InChIKeyOJARIIZPBYUSDH-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.29
Rot. Bonds4

About 4-hydroxy-4-(2-methylphenyl)butanamide

4-hydroxy-4-(2-methylphenyl)butanamide (PubChem CID 82111988) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-hydroxy-4-(2-methylphenyl)butanamide.

Molecular Properties

Compound Name4-hydroxy-4-(2-methylphenyl)butanamide
PubChem CID82111988
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name4-hydroxy-4-(2-methylphenyl)butanamide
SMILESCc1ccccc1C(O)CCC(N)=O
InChIInChI=1S/C11H15NO2/c1-8-4-2-3-5-9(8)10(13)6-7-11(12)14/h2-5,10,13H,6-7H2,1H3,(H2,12,14)
InChIKeyOJARIIZPBYUSDH-UHFFFAOYSA-N
XLogP1.29
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-hydroxy-4-(2-methylphenyl)butanamide 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 4-hydroxy-4-(2-methylphenyl)butanamide?
The IUPAC name of 4-hydroxy-4-(2-methylphenyl)butanamide (CID 82111988) is 4-hydroxy-4-(2-methylphenyl)butanamide.
What is the SMILES notation for 4-hydroxy-4-(2-methylphenyl)butanamide?
The canonical SMILES for 4-hydroxy-4-(2-methylphenyl)butanamide is Cc1ccccc1C(O)CCC(N)=O.
What is the InChIKey of 4-hydroxy-4-(2-methylphenyl)butanamide?
The InChIKey is OJARIIZPBYUSDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8-4-2-3-5-9(8)10(13)6-7-11(12)14/h2-5,10,13H,6-7H2,1H3,(H2,12,14).
What are the key properties of 4-hydroxy-4-(2-methylphenyl)butanamide?
4-hydroxy-4-(2-methylphenyl)butanamide has a molecular weight of 193.25 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-4-(2-methylphenyl)butanamide is sourced from PubChem (CID 82111988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).