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CHEBI:91810 - 4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide

ChEBI IDCHEBI:91810
ChEBI Name4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide
Stars
ASCII Name4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide
DefinitionA secondary carboxamide resulting from the formal condensation of the carboxy group of 4-amino-5-chloro-2-methoxybenzoic acid with the primary amino group of 1-azabicyclo[2.2.2]octan-3-amine.
Last Modified1 October 2025
DownloadsMolfile
FormulaC15H20ClN3O2
Net Charge0
Average Mass309.797
Monoisotopic Mass309.12440
SMILESCOc1cc(N)c(Cl)cc1C(=O)NC1CN2CCC1CC2
InChIInChI=1S/C15H20ClN3O2/c1-21-14-7-12(17)11(16)6-10(14)15(20)18-13-8-19-4-2-9(13)3-5-19/h6-7,9,13H,2-5,8,17H2,1H3,(H,18,20)
InChIKeyFEROPKNOYKURCJ-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-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide (CHEBI:91810) is a benzamides (CHEBI:22702)
4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide (CHEBI:91810) is a monochlorobenzenes (CHEBI:83403)
4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide (CHEBI:91810) is a monomethoxybenzene (CHEBI:25235)
4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide (CHEBI:91810) is a quinuclidines (CHEBI:26518)
4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide (CHEBI:91810) is a secondary carboxamide (CHEBI:140325)
4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide (CHEBI:91810) is a substituted aniline (CHEBI:48975)
Incoming Relation(s)
(R)-zacopride (CHEBI:235526) is a 4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide (CHEBI:91810)
(S)-zacopride (CHEBI:235527) is a 4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide (CHEBI:91810)
IUPAC Name 
4-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-2-methoxybenzamide
Synonyms  Source
4-amino-5-chloro-2-methoxy-N-(quinuclidin-3-yl)-benzamideChEBI
4-amino-N-1-azabicyclo[2.2.2]oct-3-yl-5-chloro-2-methoxybenzamideChEBI