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Details

Stereochemistry RACEMIC
Molecular Formula C11H15NO
Molecular Weight 177.2429
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-APDB

SMILES

CC(N)CC1=CC2=C(OCC2)C=C1

InChI

InChIKey=PZTJXZKNTPCPJL-UHFFFAOYSA-N
InChI=1S/C11H15NO/c1-8(12)6-9-2-3-11-10(7-9)4-5-13-11/h2-3,7-8H,4-6,12H2,1H3

HIDE SMILES / InChI

Molecular Formula C11H15NO
Molecular Weight 177.2429
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
130.0 nM [IC50]
Substance Class Chemical
Created
by admin
on Sat Dec 16 06:45:13 UTC 2023
Edited
by admin
on Sat Dec 16 06:45:13 UTC 2023
Record UNII
UI10BAJ8SH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-APDB
Common Name English
5-BENZOFURANETHANAMINE, 2,3-DIHYDRO-.ALPHA.-METHYL-, (±)-
Systematic Name English
5-(2-AMINOPROPYL)-2,3-DIHYDROBENZOFURAN
Systematic Name English
EMA-4
Code English
J3.334.442B
Code English
3-DESOXY-MDA
Common Name English
Classification Tree Code System Code
WIKIPEDIA Designer-drugs-5-APDB
Created by admin on Sat Dec 16 06:45:13 UTC 2023 , Edited by admin on Sat Dec 16 06:45:13 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID70934560
Created by admin on Sat Dec 16 06:45:13 UTC 2023 , Edited by admin on Sat Dec 16 06:45:13 UTC 2023
PRIMARY
CAS
152624-03-8
Created by admin on Sat Dec 16 06:45:13 UTC 2023 , Edited by admin on Sat Dec 16 06:45:13 UTC 2023
PRIMARY
FDA UNII
UI10BAJ8SH
Created by admin on Sat Dec 16 06:45:13 UTC 2023 , Edited by admin on Sat Dec 16 06:45:13 UTC 2023
PRIMARY
WIKIPEDIA
5-APDB
Created by admin on Sat Dec 16 06:45:13 UTC 2023 , Edited by admin on Sat Dec 16 06:45:13 UTC 2023
PRIMARY 5-(2-Aminopropyl)-2,3-dihydrobenzofuran (5-APDB, 3-Desoxy-MDA, EMA-4) is a putative entactogen drug of the phenethylamine and amphetamine classes.[1] It is an analogue of MDA where the heterocyclic 3-position oxygen from the 3,4-methylenedioxy ring has been replaced by a methylene bridge.[1] 6-APDB is an analogue of 5-APDB where the 4-position oxygen has been replaced by a methylene bridge instead.[1] 5-APDB was developed by a team led by David E. Nichols at Purdue University as part of their research into non-neurotoxic analogues of MDMA.[1]
PUBCHEM
192601
Created by admin on Sat Dec 16 06:45:13 UTC 2023 , Edited by admin on Sat Dec 16 06:45:13 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY