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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H28N2O3
Molecular Weight 332.4372
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-Ethylenedioxy U-51754

SMILES

CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)CC2=CC=C3OCCOC3=C2

InChI

InChIKey=XJOJZKGOCBYKGW-HZPDHXFCSA-N
InChI=1S/C19H28N2O3/c1-20(2)15-6-4-5-7-16(15)21(3)19(22)13-14-8-9-17-18(12-14)24-11-10-23-17/h8-9,12,15-16H,4-7,10-11,13H2,1-3H3/t15-,16-/m1/s1

HIDE SMILES / InChI
Molecular Formula C19H28N2O3
Molecular Weight 332.4372
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
149124
Substance Class Chemical
Created
by admin
on Wed Apr 02 19:43:35 GMT 2025
Edited
by admin
on Wed Apr 02 19:43:35 GMT 2025
Record UNII
K5EW3H7SWE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-EDO U-51754
Preferred Name English
3,4-Ethylenedioxy U-51754
Common Name English
trans-2-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-N-(2-(dimethylamino)cyclohexyl)-N-methylacetamide
Systematic Name English
rel-N-[(1R,2R)-2-(Dimethylamino)cyclohexyl]-2,3-dihydro-N-methyl-1,4-benzodioxin-6-acetamide
Systematic Name English
1,4-Benzodioxin-6-acetamide, N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-2,3-dihydro-N-methyl-, rel-
Systematic Name English
Classification Tree Code System Code
CDC 3,4-Ethylenedioxy U-51754
Created by admin on Wed Apr 02 19:43:35 GMT 2025 , Edited by admin on Wed Apr 02 19:43:35 GMT 2025
Code System Code Type Description
EPA CompTox
DTXSID601342952
Created by admin on Wed Apr 02 19:43:35 GMT 2025 , Edited by admin on Wed Apr 02 19:43:35 GMT 2025
PRIMARY
FDA UNII
K5EW3H7SWE
Created by admin on Wed Apr 02 19:43:35 GMT 2025 , Edited by admin on Wed Apr 02 19:43:35 GMT 2025
PRIMARY
CAS
2748623-91-6
Created by admin on Wed Apr 02 19:43:35 GMT 2025 , Edited by admin on Wed Apr 02 19:43:35 GMT 2025
PRIMARY
PUBCHEM
137700374
Created by admin on Wed Apr 02 19:43:35 GMT 2025 , Edited by admin on Wed Apr 02 19:43:35 GMT 2025
PRIMARY
Related Record Type Details
MU-TYPE OPIOID RECEPTOR
TARGET -> AGONIST
Assumed from being on CDC list
Structure of 3,4-Ethylenedioxy U-51754 hydrochloride
SALT/SOLVATE -> PARENT
Related Record Type Details
Structure of 3,4-Ethylenedioxy U-51754
ACTIVE MOIETY
NIH
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