CHEBI:51380 - doxylamine

ChEBI IDCHEBI:51380
ChEBI Namedoxylamine
Stars
Last Modified22 February 2017
SubmitterInma Spiteri
DownloadsMolfile
FormulaC17H22N2O
Net Charge0
Average Mass270.376
Monoisotopic Mass270.17321
SMILESCN(C)CCOC(C)(c1ccccc1)c1ccccn1
InChIInChI=1S/C17H22N2O/c1-17(20-14-13-19(2)3,15-9-5-4-6-10-15)16-11-7-8-12-18-16/h4-12H,13-14H2,1-3H3
InChIKeyHCFDWZZGGLSKEP-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
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.
histamine antagonist  Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.
cholinergic antagonist  Any drug that binds to but does not activate cholinergic receptors, thereby blocking the actions of acetylcholine or cholinergic agonists.
Applications:
antiemetic  A drug used to prevent nausea or vomiting. An antiemetic may act by a wide range of mechanisms: it might affect the medullary control centres (the vomiting centre and the chemoreceptive trigger zone) or affect the peripheral receptors.
antitussive  An agent that suppresses cough. Antitussives have a central or a peripheral action on the cough reflex, or a combination of both. Compare with expectorants, which are considered to increase the volume of secretions in the respiratory tract, so facilitating their removal by ciliary action and coughing, and mucolytics, which decrease the viscosity of mucus, facilitating its removal by ciliary action and expectoration.
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.
histamine antagonist  Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.
anti-allergic agent  A drug used to treat allergic reactions.
cholinergic antagonist  Any drug that binds to but does not activate cholinergic receptors, thereby blocking the actions of acetylcholine or cholinergic agonists.
sedative  A central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety.
ChEBI Ontology
Outgoing Relation(s)
doxylamine (CHEBI:51380) has role anti-allergic agent (CHEBI:50857)
doxylamine (CHEBI:51380) has role antiemetic (CHEBI:50919)
doxylamine (CHEBI:51380) has role antitussive (CHEBI:51177)
doxylamine (CHEBI:51380) has role cholinergic antagonist (CHEBI:48873)
doxylamine (CHEBI:51380) has role H1-receptor antagonist (CHEBI:37955)
doxylamine (CHEBI:51380) has role histamine antagonist (CHEBI:37956)
doxylamine (CHEBI:51380) has role sedative (CHEBI:35717)
doxylamine (CHEBI:51380) is a pyridines (CHEBI:26421)
doxylamine (CHEBI:51380) is a tertiary amine (CHEBI:32876)
IUPAC Name 
N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine
INNs  Source
doxylamineKEGG DRUG
doxylaminumWHO MedNet
doxylamineWHO MedNet
doxilaminaWHO MedNet
Synonyms  Source
2-(alpha-(2-(Dimethylamino)ethoxy)-alpha-methylbenzyl)pyridineChemIDplus
2-Dimethylaminoethoxyphenylmethyl-2-picolineChemIDplus
DossilaminaChemIDplus
DoxilminioChemIDplus
N,N-Dimethyl-2-(1-phenyl-1-(2-pyridinyl)ethoxy)ethanamineChemIDplus
Phenyl-2-pyridylmethyl-beta-N,N-dimethylaminoethyl etherChemIDplus
Manual XrefsDatabases
D07878KEGG DRUG
DB00366DrugBank
DoxylamineWikipedia
LSM-1563LINCS
962DrugCentral
Registry NumbersSources
Beilstein:230379Beilstein
CAS:469-21-6ChemIDplus