2-Acetyl-3-methyl-N-phenylbutanamide

HCID 13620974
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Basic information

CAS
89080-91-1
Standard SMILES
CC(=O)C(C(=O)Nc1ccccc1)C(C)C
InChIKey
KOGGVCFTLJOEPU-UHFFFAOYSA-N
Molecular formula
C13H17NO2
Average molar mass
219.28 g/mol
Monoisotopic mass
219.12592878

Names & identifiers

Preferred name
2-Acetyl-3-methyl-N-phenylbutanamide
IUPAC
2-acetyl-3-methyl-N-phenylbutanamide

Names & synonyms

2-Acetyl-3-methyl-N-phenylbutanamide89080-91-12-acetyl-2-isopropylacetanilideSCHEMBL10647387DTXSID50545214KOGGVCFTLJOEPU-UHFFFAOYSA-N

Database identifiers

CAS
89080-91-1
PubChem CID
13620974
DTXSID
DTXSID50545214

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
46.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
16

Related reactions

2 records
New reaction record

Compound notes

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