N-Acetylbutanamide

HCID 31191

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Basic information

CAS: 22534-71-0
Standard SMILES: CCCC(=O)NC(C)=O
InChIKey: IDVHWCVIBYZUKP-UHFFFAOYSA-N
Molecular formula: C6H11NO2
Average molar mass: 129.16 g/mol
Monoisotopic mass: 129.07897859

Names & identifiers

Preferred name: N-Acetylbutanamide
IUPAC: N-acetylbutanamide

Names & synonyms

N-ACETYLBUTANAMIDE22534-71-0DTXSID70177051RefChem:363141DTXCID8099542N-acetylbutyramideSCHEMBL936835SCHEMBL1303420SCHEMBL1303421SCHEMBL6973220SCHEMBL6973600

Database identifiers

CAS: 22534-71-0
PubChem CID: 31191
DTXSID: DTXSID70177051
Nikkaji: J1.610.304G

Properties

Computed structural properties

XLogP: 0.1
Topological polar surface area: 46.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 9
Formal charge: 0
Complexity: 120

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