potassium 3-hydroxy-N-oxidobutanamide

C4H8KNO3 — CID 130127613

IUPACpotassium 3-hydroxy-N-oxidobutanamide
SMILESCC(O)CC(=O)N[O-].[K+]
InChIInChI=1S/C4H8NO3.K/c1-3(6)2-4(7)5-8;/h3,6H,2H2,1H3,(H-,5,7,8);/q-1;+1
InChIKeyLFGMXPBRDOEHJQ-UHFFFAOYSA-N
MW157.21 g/mol
LogP-3.62
Rot. Bonds2

About potassium 3-hydroxy-N-oxidobutanamide

potassium 3-hydroxy-N-oxidobutanamide (PubChem CID 130127613) has the molecular formula C4H8KNO3 and a molecular weight of 157.21 g/mol. Its IUPAC name is potassium 3-hydroxy-N-oxidobutanamide.

Molecular Properties

Compound Namepotassium 3-hydroxy-N-oxidobutanamide
PubChem CID130127613
Molecular FormulaC4H8KNO3
Molecular Weight157.21 g/mol
Exact Mass157.01
IUPAC Namepotassium 3-hydroxy-N-oxidobutanamide
SMILESCC(O)CC(=O)N[O-].[K+]
InChIInChI=1S/C4H8NO3.K/c1-3(6)2-4(7)5-8;/h3,6H,2H2,1H3,(H-,5,7,8);/q-1;+1
InChIKeyLFGMXPBRDOEHJQ-UHFFFAOYSA-N
XLogP-3.62
TPSA72.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 5-3.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze potassium 3-hydroxy-N-oxidobutanamide 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

potassium 4-hydroxy-2-oxopentanoate
CID 169441902
potassium (3R)-3-hydroxybutanoate
CID 23704427
(Z)-2,3-bis(2-hydroxypropyl)but-2-enedioate
CID 22903088
(3R)-3-hydroxy-N-[(2R)-3-methylbutan-2-yl]butanamide
CID 89065731
CID 90459779
CID 90459779
5-hydroxy-2-methylhexan-3-one
CID 536853
N-(2,2-dimethylpropyl)-3-hydroxybutanamide
CID 87908757
disodium bis(3-hydroxybutanoate)
CID 140970617
3-hydroxy-N-(2-methylbutan-2-yl)butanamide
CID 87908743
(3S)-3-hydroxy-N-(4-methylcyclohexyl)butanamide
CID 89423792
sodium;hydride;(3S)-3-hydroxybutanoic acid
CID 173289884
11-methyl-N-oxidododecanamide
CID 71301385

Frequently Asked Questions

What is the IUPAC name of potassium 3-hydroxy-N-oxidobutanamide?
The IUPAC name of potassium 3-hydroxy-N-oxidobutanamide (CID 130127613) is potassium 3-hydroxy-N-oxidobutanamide.
What is the SMILES notation for potassium 3-hydroxy-N-oxidobutanamide?
The canonical SMILES for potassium 3-hydroxy-N-oxidobutanamide is CC(O)CC(=O)N[O-].[K+].
What is the InChIKey of potassium 3-hydroxy-N-oxidobutanamide?
The InChIKey is LFGMXPBRDOEHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8NO3.K/c1-3(6)2-4(7)5-8;/h3,6H,2H2,1H3,(H-,5,7,8);/q-1;+1.
What are the key properties of potassium 3-hydroxy-N-oxidobutanamide?
potassium 3-hydroxy-N-oxidobutanamide has a molecular weight of 157.21 g/mol, XLogP of -3.62, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 3-hydroxy-N-oxidobutanamide is sourced from PubChem (CID 130127613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).