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

Details

Stereochemistry ACHIRAL
Molecular Formula C24H36N2O2
Molecular Weight 384.5548
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-[2-(3,4-dimethoxyphenyl)ethyl]-N′-(2-phenylethyl)hexane-1,6-diamine

SMILES

COC1=C(OC)C=C(CCNCCCCCCNCCC2=CC=CC=C2)C=C1

InChI

InChIKey=PRLFIKKGRPLYBY-UHFFFAOYSA-N
InChI=1S/C24H36N2O2/c1-27-23-13-12-22(20-24(23)28-2)15-19-26-17-9-4-3-8-16-25-18-14-21-10-6-5-7-11-21/h5-7,10-13,20,25-26H,3-4,8-9,14-19H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C24H36N2O2
Molecular Weight 384.5548
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:56:27 GMT 2023
Edited
by admin
on Sat Dec 16 19:56:27 GMT 2023
Record UNII
5L6GW34SSZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-[2-(3,4-dimethoxyphenyl)ethyl]-N′-(2-phenylethyl)hexane-1,6-diamine
Systematic Name English
N<SUP>1</SUP>-[2-(3,4-Dimethoxyphenyl)ethyl]-N<SUP>6</SUP>-(2-phenylethyl)-1,6-hexanediamine (
Systematic Name English
1,6-Hexanediamine, N-[2-(3,4-dimethoxyphenyl)ethyl]-N′-(2-phenylethyl)-
Systematic Name English
Dopexamine Dihydrochloride Impurity H [EP Impurity]
Common Name English
Code System Code Type Description
FDA UNII
5L6GW34SSZ
Created by admin on Sat Dec 16 19:56:27 GMT 2023 , Edited by admin on Sat Dec 16 19:56:27 GMT 2023
PRIMARY
PUBCHEM
13935770
Created by admin on Sat Dec 16 19:56:27 GMT 2023 , Edited by admin on Sat Dec 16 19:56:27 GMT 2023
PRIMARY
CAS
86480-27-5
Created by admin on Sat Dec 16 19:56:27 GMT 2023 , Edited by admin on Sat Dec 16 19:56:27 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY