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Details

Stereochemistry RACEMIC
Molecular Formula C12H17N.ClH
Molecular Weight 211.731
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-APDI HYDROCHLORIDE

SMILES

Cl.CC(N)CC1=CC2=C(CCC2)C=C1

InChI

InChIKey=BYDGFBRMZHXMBV-UHFFFAOYSA-N
InChI=1S/C12H17N.ClH/c1-9(13)7-10-5-6-11-3-2-4-12(11)8-10;/h5-6,8-9H,2-4,7,13H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C12H17N
Molecular Weight 175.2701
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
82.0 nM [IC50]
1.85 µM [IC50]
849.0 nM [IC50]
Substance Class Chemical
Created
by admin
on Sat Dec 16 10:50:17 UTC 2023
Edited
by admin
on Sat Dec 16 10:50:17 UTC 2023
Record UNII
1ZK048AEUE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-APDI HYDROCHLORIDE
Common Name English
5-(2-AMINOPROPYL)-2,3-DIHYDRO-1H-INDENE HYDROCHLORIDE
Systematic Name English
1H-INDENE-5-ETHANAMINE, 2,3-DIHYDRO-.ALPHA.-METHYL-, HYDROCHLORIDE, (±)-
Systematic Name English
1H-INDENE-5-ETHANAMINE, 2,3-DIHYDRO-.ALPHA.-METHYL-, HYDROCHLORIDE
Systematic Name English
1H-INDENE-5-ETHANAMINE, 2,3-DIHYDRO-.ALPHA.-METHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
1ZK048AEUE
Created by admin on Sat Dec 16 10:50:17 UTC 2023 , Edited by admin on Sat Dec 16 10:50:17 UTC 2023
PRIMARY
PUBCHEM
112500491
Created by admin on Sat Dec 16 10:50:17 UTC 2023 , Edited by admin on Sat Dec 16 10:50:17 UTC 2023
PRIMARY
CAS
152623-95-5
Created by admin on Sat Dec 16 10:50:17 UTC 2023 , Edited by admin on Sat Dec 16 10:50:17 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE