EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:106031 - 4-amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile

ChEBI IDCHEBI:106031
ChEBI Name4-amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile
Stars
DownloadsMolfile
FormulaC14H10F5N3O2
Net Charge0
Average Mass347.243
Monoisotopic Mass347.06932
SMILESCOc1ccc(OC)c2c(N)c(C#N)c(C(F)(F)C(F)(F)F)nc12
InChIInChI=1S/C14H10F5N3O2/c1-23-7-3-4-8(24-2)11-9(7)10(21)6(5-20)12(22-11)13(15,16)14(17,18)19/h3-4H,1-2H3,(H2,21,22)
InChIKeyBGMUZNANPQUDEH-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)
4-amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile (CHEBI:106031) is a aminoquinoline (CHEBI:36709)
Manual XrefsDatabases
LSM-17392LINCS