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

ChEBI IDCHEBI:176340
ChEBI Name2-methyl-3-(pyrrolidin-1-yl)-1-[4-(trifluoromethyl)phenyl]propan-1-one
Stars
DefinitionAn 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.
Last Modified4 June 2021
SubmitterAdnan
DownloadsMolfile
FormulaC15H18F3NO
Net Charge0
Average Mass285.309
Monoisotopic Mass285.13405
SMILESCC(CN1CCCC1)C(=O)c1ccc(C(F)(F)F)cc1
InChIInChI=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
InChIKeyRYZCWZZJFAKYHX-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
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 Relation(s)
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-propanoneChEBI