CHEBI:186232 - Thenyldiamine

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ChEBI Name Thenyldiamine
ChEBI ID CHEBI:186232
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H19N3S
Net Charge 0
Average Mass 261.390
Monoisotopic Mass 261.12997
InChI InChI=1S/C14H19N3S/c1-16(2)8-9-17(11-13-6-10-18-12-13)14-5-3-4-7-15-14/h3-7,10,12H,8-9,11H2,1-2H3
InChIKey RCGYDFVCAAKKNG-UHFFFAOYSA-N
SMILES S1C=C(CN(CCN(C)C)C=2N=CC=CC2)C=C1
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Thenyldiamine (CHEBI:186232) is a dialkylarylamine (CHEBI:23665)
Thenyldiamine (CHEBI:186232) is a tertiary amino compound (CHEBI:50996)
IUPAC Name
N,N-dimethyl-N'-pyridin-2-yl-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine
Manual Xrefs Databases
6799 ChemSpider
DB16022 KEGG DRUG
HMDB0240241 HMDB
View more database links
Registry Number Type Source
91-79-2 CAS Registry Number ChemIDplus