CHEBI:43533 - 1,5,5-trimethylpyrrolidin-2-one

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ChEBI Name 1,5,5-trimethylpyrrolidin-2-one
ChEBI ID CHEBI:43533
Definition A member of the class of pyrrolidine-2-ones that is pyrrolidine-2-one in which the hydrogen attached to the nitrogen and both of the hydrogens at position 5 are replaced by methyl groups.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:36593, CHEBI:43530
Supplier Information
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Formula C7H13NO
Net Charge 0
Average Mass 127.18420
Monoisotopic Mass 127.09971
InChI InChI=1S/C7H13NO/c1-7(2)5-4-6(9)8(7)3/h4-5H2,1-3H3
InChIKey YARDEGUIPATLSG-UHFFFAOYSA-N
SMILES CN1C(=O)CCC1(C)C
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 1,5,5-trimethylpyrrolidin-2-one (CHEBI:43533) is a N-alkylpyrrolidine (CHEBI:46775)
1,5,5-trimethylpyrrolidin-2-one (CHEBI:43533) is a pyrrolidin-2-ones (CHEBI:74223)
IUPAC Name
1,5,5-trimethylpyrrolidin-2-one
Synonym Source
1-METHYL-2-OXY-5,5-DIMETHYL PYRROLIDINE PDBeChem
Manual Xref Database
DB03968 DrugBank
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Registry Numbers Types Sources
109346 Beilstein Registry Number Beilstein
109346 Reaxys Registry Number Reaxys
Last Modified
20 November 2019