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Details

Stereochemistry RACEMIC
Molecular Formula C16H24ClN
Molecular Weight 265.822
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESMETHYLSIBUTRAMINE

SMILES

CC(C)CC(C1(CCC1)c2ccc(cc2)Cl)NC

InChI

InChIKey=PLXKZKLXYHLWHR-UHFFFAOYSA-N
InChI=1S/C16H24ClN/c1-12(2)11-15(18-3)16(9-4-10-16)13-5-7-14(17)8-6-13/h5-8,12,15,18H,4,9-11H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C16H24ClN
Molecular Weight 265.822
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 05:44:08 UTC 2021
Edited
by admin
on Sat Jun 26 05:44:08 UTC 2021
Record UNII
889I657R9P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESMETHYLSIBUTRAMINE
Common Name English
1-(4-CHLOROPHENYL)-N-METHYL-.ALPHA.-(2-METHYLPROPYL)CYCLOBUTANEMETHANAMINE
Systematic Name English
(+/-)-DESMETHYLSIBUTRAMINE
Common Name English
CYCLOBUTANEMETHANAMINE, 1-(4-CHLOROPHENYL)-N-METHYL-.ALPHA.-(2-METHYLPROPYL)-
Systematic Name English
N-METHYL-N-(1-(1-(4-CHLOROPHENYL)CYCLOBUTYL)-3-METHYLBUTAN-1-YL)AMINE
Systematic Name English
N-DESMETHYLSIBUTRAMINE
Common Name English
N-MONO-DESMETHYLSIBUTRAMINE
Common Name English
Code System Code Type Description
FDA UNII
889I657R9P
Created by admin on Sat Jun 26 05:44:08 UTC 2021 , Edited by admin on Sat Jun 26 05:44:08 UTC 2021
PRIMARY
PUBCHEM
10199199
Created by admin on Sat Jun 26 05:44:08 UTC 2021 , Edited by admin on Sat Jun 26 05:44:08 UTC 2021
PRIMARY
CAS
168835-59-4
Created by admin on Sat Jun 26 05:44:08 UTC 2021 , Edited by admin on Sat Jun 26 05:44:08 UTC 2021
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
BINDER->LIGAND
ENANTIOMER -> RACEMATE
Related Record Type Details
PARENT -> METABOLITE
Related Record Type Details
ACTIVE MOIETY