Summary

IMPPAT Phytochemical identifier: IMPHY011464

Phytochemical name: Isobutyramide

Synonymous chemical names:
isobutyl amide, isobutylamide, isobutyramide

External chemical identifiers:
CID:68424, ChEMBL:CHEMBL352219, ZINC:ZINC000001484944, FDASRS:82UOE7B38Z, SureChEMBL:SCHEMBL3323, MolPort-001-780-137

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Chemical structure information

SMILES:
CC(C(=O)N)C

InChI:
InChI=1S/C4H9NO/c1-3(2)4(5)6/h3H,1-2H3,(H2,5,6)

InChIKey:
WFKAJVHLWXSISD-UHFFFAOYSA-N

DeepSMILES:
CCC=O)N))C

Functional groups:
CC(N)=O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic acids and derivatives

ClassyFire Class: Carboxylic acids and derivatives

ClassyFire Subclass: Carboxylic acid derivatives

NP Classifier Biosynthetic pathway: Alkaloids

NP-Likeness score: -0.119

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Chemical structure download