CHEBI:176340 - 2-methyl-3-(pyrrolidin-1-yl)-1-[4-(trifluoromethyl)phenyl]propan-1-one

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ChEBI Name 2-methyl-3-(pyrrolidin-1-yl)-1-[4-(trifluoromethyl)phenyl]propan-1-one
ChEBI ID CHEBI:176340
Definition An aromatic ketone that is (trifluoromethyl)benzene in which the hydrogen at position 4 is replaced by a 2-methyl-3-(pyrrolidin-1-yl)propanoyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C15H18F3NO
Net Charge 0
Average Mass 285.310
Monoisotopic Mass 285.13405
InChI InChI=1S/C15H18F3NO/c1-11(10-19-8-2-3-9-19)14(20)12-4-6-13(7-5-12)15(16,17)18/h4-7,11H,2-3,8-10H2,1H3
InChIKey RYZCWZZJFAKYHX-UHFFFAOYSA-N
SMILES CC(CN1CCCC1)C(=O)C1=CC=C(C=C1)C(F)(F)F
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-methyl-3-(pyrrolidin-1-yl)-1-[4-(trifluoromethyl)phenyl]propan-1-one (CHEBI:176340) is a (trifluoromethyl)benzenes (CHEBI:83565)
2-methyl-3-(pyrrolidin-1-yl)-1-[4-(trifluoromethyl)phenyl]propan-1-one (CHEBI:176340) is a aromatic ketone (CHEBI:76224)
2-methyl-3-(pyrrolidin-1-yl)-1-[4-(trifluoromethyl)phenyl]propan-1-one (CHEBI:176340) is a pyrrolidines (CHEBI:38260)
2-methyl-3-(pyrrolidin-1-yl)-1-[4-(trifluoromethyl)phenyl]propan-1-one (CHEBI:176340) is a tertiary amino compound (CHEBI:50996)
Incoming lanperisone (CHEBI:176339) is a 2-methyl-3-(pyrrolidin-1-yl)-1-[4-(trifluoromethyl)phenyl]propan-1-one (CHEBI:176340)
IUPAC Name
2-methyl-3-(pyrrolidin-1-yl)-1-[4-(trifluoromethyl)phenyl]propan-1-one
Synonym Source
1-(4-trifluoromethylphenyl)-2-methyl-3-pyrrolidino-1-propanone ChEBI
Last Modified
04 June 2021