EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:94767 - N'-[(4-chlorophenyl)methyl]-N,N-dimethyl-N'-(2-pyridinyl)ethane-1,2-diamine

ChEBI IDCHEBI:94767
ChEBI NameN'-[(4-chlorophenyl)methyl]-N,N-dimethyl-N'-(2-pyridinyl)ethane-1,2-diamine
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC16H20ClN3
Net Charge0
Average Mass289.810
Monoisotopic Mass289.13458
SMILESCN(C)CCN(Cc1ccc(Cl)cc1)c1ccccn1
InChIInChI=1S/C16H20ClN3/c1-19(2)11-12-20(16-5-3-4-10-18-16)13-14-6-8-15(17)9-7-14/h3-10H,11-13H2,1-2H3
InChIKeyICKFFNBDFNZJSX-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)
N'-[(4-chlorophenyl)methyl]-N,N-dimethyl-N'-(2-pyridinyl)ethane-1,2-diamine (CHEBI:94767) is a aminopyridine (CHEBI:38207)
Synonyms  Source
chloropyramine hydrochlorideDrugCentral
chlorpyramineDrugCentral
chlorneoanterganDrugCentral
chloropyribenzamineDrugCentral
halopyramineDrugCentral
chloropyramine HClDrugCentral
Manual XrefsDatabases
LSM-5896LINCS
606DrugCentral
HMDB0015690HMDB
Registry NumbersSources
CAS:59-32-5DrugCentral