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CHEBI:194299 - 5-amino-1-[3-fluoro-4-(morpholin-4-yl)phenyl]imidazole-4-carbonitrile

ChEBI IDCHEBI:194299
ChEBI Name5-amino-1-[3-fluoro-4-(morpholin-4-yl)phenyl]imidazole-4-carbonitrile
Stars
DefinitionA member of the class of monofluorobenzenes that is benzene substituted by 5-amino-4-cyano-1H-imidazol-1-yl, fluoro, and morpholin-4-yl groups at positions 1, 3 and 4, respectively.
Last Modified23 January 2023
Submitterkalra
DownloadsMolfile
FormulaC14H14FN5O
Net Charge0
Average Mass287.298
Monoisotopic Mass287.11824
SMILESN#Cc1ncn(-c2ccc(N3CCOCC3)c(F)c2)c1N
InChIInChI=1S/C14H14FN5O/c15-11-7-10(20-9-18-12(8-16)14(20)17)1-2-13(11)19-3-5-21-6-4-19/h1-2,7,9H,3-6,17H2
InChIKeyAQKZVVFVHVGQPH-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)
5-amino-1-[3-fluoro-4-(morpholin-4-yl)phenyl]imidazole-4-carbonitrile (CHEBI:194299) is a aminoimidazole (CHEBI:22512)
5-amino-1-[3-fluoro-4-(morpholin-4-yl)phenyl]imidazole-4-carbonitrile (CHEBI:194299) is a monofluorobenzenes (CHEBI:83575)
5-amino-1-[3-fluoro-4-(morpholin-4-yl)phenyl]imidazole-4-carbonitrile (CHEBI:194299) is a morpholines (CHEBI:38785)
5-amino-1-[3-fluoro-4-(morpholin-4-yl)phenyl]imidazole-4-carbonitrile (CHEBI:194299) is a nitrile (CHEBI:18379)
5-amino-1-[3-fluoro-4-(morpholin-4-yl)phenyl]imidazole-4-carbonitrile (CHEBI:194299) is a primary amino compound (CHEBI:50994)
IUPAC Name 
5-amino-1-[3-fluoro-4-(morpholin-4-yl)phenyl]-1H-imidazole-4-carbonitrile
Synonym  Source
5-amino-1-(3-fluoro-4-morpholinophenyl)-1H-imidazole-4-carbonitrileChEBI