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cotinine N-oxide

Go to external page http://purl.obolibrary.org/obo/CHEBI_89087

An N-alkylpyrrolidine that is nicotine in which the methylene hydrogens at position 2 on the pyrrolidine ring have been replaced by an oxo group and the pyridine nitrogen converted to the corresponding N-oxide. A minor metabolite of nicotine.

Term info

Label

cotinine N-oxide

Synonyms
  • (5S)-1-methyl-5-(1-oxo-1lambda(5)-pyridin-3-yl)pyrrolidin-2-one
database cross reference
Subsets

3_STAR

IUPAC NAME
(5S)-1-methyl-5-(1-oxo-1lambda(5)-pyridin-3-yl)pyrrolidin-2-one [ IUPAC ]

charge

0

formula

C10H12N2O2

has obo namespace

chebi_ontology

has related synonym

(S)-1-methyl-5-(1-oxido-3-pyridinyl)-2-Pyrrolidinone, 3-[(2S)-1-methyl-5-oxopyrrolidin-2-yl]pyridin-1-ium-1-olate, (-)-cotinine N-oxide, (5S)-1-methyl-5-(1-oxido-3-pyridinyl)-2-pyrrolidinone, (S)-1-methyl-5-(3-pyridinyl)-2-Pyrrolidinone N-oxide, Cotinine-N-oxide

id

CHEBI:89087

inchi

InChI=1S/C10H12N2O2/c1-11-9(4-5-10(11)13)8-3-2-6-12(14)7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1

inchikey

CIPULDKLIIVIER-VIFPVBQESA-N

mass

192.215

monoisotopicmass

192.08988

smiles

CN1[C@@](CCC1=O)(C2=C[N+](=CC=C2)[O-])[H]