CHEBI:2946 - azatadine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name azatadine
ChEBI ID CHEBI:2946
Definition A benzo[5,6]cyclohepta[1,2-b]pyridine having a 1-methylpiperidin-4-ylidene group at the 11-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula C20H22N2
Net Charge 0
Average Mass 290.40210
Monoisotopic Mass 290.178
InChI InChI=1S/C20H22N2/c1-22-13-10-16(11-14-22)19-18-7-3-2-5-15(18)8-9-17-6-4-12-21-20(17)19/h2-7,12H,8-11,13-14H2,1H3
InChIKey SEBMTIQKRHYNIT-UHFFFAOYSA-N
SMILES CN1CCC(CC1)=C1c2ccccc2CCc2cccnc12
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): H1-receptor antagonist
H1-receptor antagonists are the drugs that selectively bind to but do not activate histamine H1 receptors, thereby blocking the actions of endogenous histamine.
Application(s): H1-receptor antagonist
H1-receptor antagonists are the drugs that selectively bind to but do not activate histamine H1 receptors, thereby blocking the actions of endogenous histamine.
anti-allergic agent
A drug used to treat allergic reactions.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing azatadine (CHEBI:2946) has role anti-allergic agent (CHEBI:50857)
azatadine (CHEBI:2946) has role H1-receptor antagonist (CHEBI:37955)
azatadine (CHEBI:2946) is a benzocycloheptapyridine (CHEBI:48593)
azatadine (CHEBI:2946) is a tertiary amine (CHEBI:32876)
Incoming azatadine maleate (CHEBI:2947) has part azatadine (CHEBI:2946)
IUPAC Name
11-(1-methylpiperidin-4-ylidene)-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine
INNs Sources
azatadina DrugBank
azatadine KEGG DRUG
azatadinum DrugBank
Synonyms Sources
11-(1-Methyl-4-piperidinylidene)-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine NIST Chemistry WebBook
6,11-Dihydro-11-(1-methyl-4-piperidylidene)-5H-benzo(5,6)cyclohepta(1,2-b)pyridine ChemIDplus
Manual Xrefs Databases
268 DrugCentral
Azatadine Wikipedia
BE647043 Patent
C07774 KEGG COMPOUND
D07482 KEGG DRUG
DB00719 DrugBank
US3326924 Patent
View more database links
Registry Numbers Types Sources
3964-81-6 CAS Registry Number KEGG DRUG
3964-81-6 CAS Registry Number NIST Chemistry WebBook
3964-81-6 CAS Registry Number ChemIDplus
3964-81-6 CAS Registry Number DrugBank
889600 Beilstein Registry Number Beilstein
Last Modified
22 February 2017