CHEBI:43460 - N-{2'-[(4-fluorophenyl)amino]-4,4'-bipyridin-2-yl}-4-methoxycyclohexanecarboxamide

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ChEBI Name N-{2'-[(4-fluorophenyl)amino]-4,4'-bipyridin-2-yl}-4-methoxycyclohexanecarboxamide
ChEBI ID CHEBI:43460
ChEBI ASCII Name N-{2'-[(4-fluorophenyl)amino]-4,4'-bipyridin-2-yl}-4-methoxycyclohexanecarboxamide
Definition A member of the class of bipyridines that is 4,4'-bipyridine substituted at positions 2 and 2' by 4-fluoroaminophenyl and 4-methoxycyclohexanecarboxamido groups respectively.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C24H25FN4O2
Net Charge 0
Average Mass 420.47930
Monoisotopic Mass 420.19615
InChI InChI=1S/C24H25FN4O2/c1-31-21-8-2-16(3-9-21)24(30)29-23-15-18(11-13-27-23)17-10-12-26-22(14-17)28-20-6-4-19(25)5-7-20/h4-7,10-16,21H,2-3,8-9H2,1H3,(H,26,28)(H,27,29,30)
InChIKey ACGBFWCBVIXTPZ-UHFFFAOYSA-N
SMILES COC1CCC(CC1)C(=O)Nc1cc(ccn1)-c1ccnc(Nc2ccc(F)cc2)c1
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 N-{2'-[(4-fluorophenyl)amino]-4,4'-bipyridin-2-yl}-4-methoxycyclohexanecarboxamide (CHEBI:43460) is a aromatic amine (CHEBI:33860)
N-{2'-[(4-fluorophenyl)amino]-4,4'-bipyridin-2-yl}-4-methoxycyclohexanecarboxamide (CHEBI:43460) is a bipyridines (CHEBI:50511)
N-{2'-[(4-fluorophenyl)amino]-4,4'-bipyridin-2-yl}-4-methoxycyclohexanecarboxamide (CHEBI:43460) is a ether (CHEBI:25698)
N-{2'-[(4-fluorophenyl)amino]-4,4'-bipyridin-2-yl}-4-methoxycyclohexanecarboxamide (CHEBI:43460) is a monocarboxylic acid amide (CHEBI:29347)
N-{2'-[(4-fluorophenyl)amino]-4,4'-bipyridin-2-yl}-4-methoxycyclohexanecarboxamide (CHEBI:43460) is a organofluorine compound (CHEBI:37143)
N-{2'-[(4-fluorophenyl)amino]-4,4'-bipyridin-2-yl}-4-methoxycyclohexanecarboxamide (CHEBI:43460) is a secondary amino compound (CHEBI:50995)
IUPAC Name
N-{2'-[(4-fluorophenyl)amino]-4,4'-bipyridin-2-yl}-4-methoxycyclohexanecarboxamide
Manual Xrefs Databases
DB08025 DrugBank
JNK PDBeChem
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Registry Number Type Source
26129689 Reaxys Registry Number Reaxys
Last Modified
22 August 2014