CHEBI:74687 - N-acetylethanolamine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-acetylethanolamine
ChEBI ID CHEBI:74687
ChEBI ASCII Name N-acetylethanolamine
Definition A member of the class of ethanolamines that is 2-aminoethanol in which one of the hydrogens of the amino group is replaced by an acetyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C4H9NO2
Net Charge 0
Average Mass 103.11980
Monoisotopic Mass 103.063
InChI InChI=1S/C4H9NO2/c1-4(7)5-2-3-6/h6H,2-3H2,1H3,(H,5,7)
InChIKey PVCJKHHOXFKFRP-UHFFFAOYSA-N
SMILES CC(=O)NCCO
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-acetylethanolamine (CHEBI:74687) has role metabolite (CHEBI:25212)
N-acetylethanolamine (CHEBI:74687) is a acetamides (CHEBI:22160)
N-acetylethanolamine (CHEBI:74687) is a ethanolamines (CHEBI:23981)
N-acetylethanolamine (CHEBI:74687) is a monocarboxylic acid amide (CHEBI:29347)
IUPAC Name
N-(2-hydroxyethyl)acetamide
Manual Xref Database
CN101525301 Patent
View more database links
Registry Numbers Types Sources
142-26-7 CAS Registry Number ChemIDplus
1811708 Reaxys Registry Number Reaxys
Last Modified
12 March 2015