3-hydroxy-4-methyl-2-oxopentanamide

C6H11NO3 — CID 141452509

IUPAC3-hydroxy-4-methyl-2-oxopentanamide
SMILESCC(C)C(O)C(=O)C(N)=O
InChIInChI=1S/C6H11NO3/c1-3(2)4(8)5(9)6(7)10/h3-4,8H,1-2H3,(H2,7,10)
InChIKeyXUPQQTMLYMHXNP-UHFFFAOYSA-N
MW145.16 g/mol
LogP-0.94
Rot. Bonds3

About 3-hydroxy-4-methyl-2-oxopentanamide

3-hydroxy-4-methyl-2-oxopentanamide (PubChem CID 141452509) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 3-hydroxy-4-methyl-2-oxopentanamide.

Molecular Properties

Compound Name3-hydroxy-4-methyl-2-oxopentanamide
PubChem CID141452509
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name3-hydroxy-4-methyl-2-oxopentanamide
SMILESCC(C)C(O)C(=O)C(N)=O
InChIInChI=1S/C6H11NO3/c1-3(2)4(8)5(9)6(7)10/h3-4,8H,1-2H3,(H2,7,10)
InChIKeyXUPQQTMLYMHXNP-UHFFFAOYSA-N
XLogP-0.94
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-0.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze 3-hydroxy-4-methyl-2-oxopentanamide 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

[(2R)-1-amino-3-methyl-1-oxobutan-2-yl] (2R)-2-hydroxy-3-methylbutanoate
CID 162816355
dimethylphosphane;2-hydroxypropanamide
CID 174842276
2,3-dimethylbutanediamide
CID 55281411
carbamic acid;ethane-1,1-diol
CID 175516501
propan-2-yl (2S)-2-hydroxy-3-methylbutanoate
CID 87171690
CID 58373917
CID 58373917
CID 170844591
CID 170844591
(3R)-3-hydroxy-2-methylbutanamide
CID 134245367
3-methyl-2-(sulfanylamino)butanamide
CID 166473642
(2R,3S)-2-amino-3-hydroxybutanamide
CID 22877840
(2R)-2,3,3-trimethylbutanamide
CID 11579125
butane;2-hydroxypropanamide
CID 87347972

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-4-methyl-2-oxopentanamide?
The IUPAC name of 3-hydroxy-4-methyl-2-oxopentanamide (CID 141452509) is 3-hydroxy-4-methyl-2-oxopentanamide.
What is the SMILES notation for 3-hydroxy-4-methyl-2-oxopentanamide?
The canonical SMILES for 3-hydroxy-4-methyl-2-oxopentanamide is CC(C)C(O)C(=O)C(N)=O.
What is the InChIKey of 3-hydroxy-4-methyl-2-oxopentanamide?
The InChIKey is XUPQQTMLYMHXNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-3(2)4(8)5(9)6(7)10/h3-4,8H,1-2H3,(H2,7,10).
What are the key properties of 3-hydroxy-4-methyl-2-oxopentanamide?
3-hydroxy-4-methyl-2-oxopentanamide has a molecular weight of 145.16 g/mol, XLogP of -0.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-4-methyl-2-oxopentanamide is sourced from PubChem (CID 141452509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).