U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C15H18N2O
Molecular Weight 242.3162
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-DIDESMETHYLDOXYLAMINE

SMILES

CC(OCCN)(C1=CC=CC=C1)C2=CC=CC=N2

InChI

InChIKey=TWDYZENQYRFODS-UHFFFAOYSA-N
InChI=1S/C15H18N2O/c1-15(18-12-10-16,13-7-3-2-4-8-13)14-9-5-6-11-17-14/h2-9,11H,10,12,16H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
N,N-DIDESMETHYLDOXYLAMINE
Common Name English
ETHANAMINE, 2-(1-PHENYL-1-(2-PYRIDINYL)ETHOXY)-
Systematic Name English
DIDEMETHYLDOXYLAMINE
Common Name English
Code System Code Type Description
PUBCHEM
71401588
Created by admin on Sat Dec 16 09:41:04 GMT 2023 , Edited by admin on Sat Dec 16 09:41:04 GMT 2023
PRIMARY
FDA UNII
5P0QF5KR0F
Created by admin on Sat Dec 16 09:41:04 GMT 2023 , Edited by admin on Sat Dec 16 09:41:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID40822622
Created by admin on Sat Dec 16 09:41:04 GMT 2023 , Edited by admin on Sat Dec 16 09:41:04 GMT 2023
PRIMARY
CAS
78868-04-9
Created by admin on Sat Dec 16 09:41:04 GMT 2023 , Edited by admin on Sat Dec 16 09:41:04 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of DOXYLAMINE
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966