4-hydroxy-4-methyl-N-phenylpentanamide

C12H17NO2 — CID 564630

IUPAC4-hydroxy-4-methyl-N-phenylpentanamide
SMILESCC(C)(O)CCC(=O)Nc1ccccc1
InChIInChI=1S/C12H17NO2/c1-12(2,15)9-8-11(14)13-10-6-4-3-5-7-10/h3-7,15H,8-9H2,1-2H3,(H,13,14)
InChIKeySHYAKVNNZVPTQE-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.18
Rot. Bonds4

About 4-hydroxy-4-methyl-N-phenylpentanamide

4-hydroxy-4-methyl-N-phenylpentanamide (PubChem CID 564630) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 4-hydroxy-4-methyl-N-phenylpentanamide.

Molecular Properties

Compound Name4-hydroxy-4-methyl-N-phenylpentanamide
PubChem CID564630
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name4-hydroxy-4-methyl-N-phenylpentanamide
SMILESCC(C)(O)CCC(=O)Nc1ccccc1
InChIInChI=1S/C12H17NO2/c1-12(2,15)9-8-11(14)13-10-6-4-3-5-7-10/h3-7,15H,8-9H2,1-2H3,(H,13,14)
InChIKeySHYAKVNNZVPTQE-UHFFFAOYSA-N
XLogP2.18
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-hydroxy-4-methyl-N-phenylpentanamide 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

6-amino-4,4-dimethyl-N-phenylhexanamide
CID 65292724
methyl 5-anilino-2,2-dimethyl-5-oxopentanoate
CID 70281853
3-fluoro-N-phenylpropanamide
CID 70366284
7,7-dimethyl-N-phenyloctanamide
CID 68837139
3,3-difluoro-N-phenylbutanamide
CID 131059355
4,4-dimethyl-6-oxo-N,7-diphenylheptanamide
CID 160928097
9,9,9-trifluoro-8,8-dihydroxy-N-phenylnonanamide
CID 122391197
N-(2-anilino-2-oxoethyl)-4-methyl-4-phenylpentanamide
CID 110353745
N'-(4-tert-butylphenyl)-N-phenylpropanediamide
CID 108952831
(3-anilino-3-oxopropyl)-dimethylsulfanium
CID 10786108
(3-anilino-3-oxopropyl)-trimethylazanium
CID 173269381
(4R)-4-hydroxy-N-phenylhexanamide
CID 155936166

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-4-methyl-N-phenylpentanamide?
The IUPAC name of 4-hydroxy-4-methyl-N-phenylpentanamide (CID 564630) is 4-hydroxy-4-methyl-N-phenylpentanamide.
What is the SMILES notation for 4-hydroxy-4-methyl-N-phenylpentanamide?
The canonical SMILES for 4-hydroxy-4-methyl-N-phenylpentanamide is CC(C)(O)CCC(=O)Nc1ccccc1.
What is the InChIKey of 4-hydroxy-4-methyl-N-phenylpentanamide?
The InChIKey is SHYAKVNNZVPTQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-12(2,15)9-8-11(14)13-10-6-4-3-5-7-10/h3-7,15H,8-9H2,1-2H3,(H,13,14).
What are the key properties of 4-hydroxy-4-methyl-N-phenylpentanamide?
4-hydroxy-4-methyl-N-phenylpentanamide has a molecular weight of 207.27 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-4-methyl-N-phenylpentanamide is sourced from PubChem (CID 564630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).