Sibutramine hydrochloride

C17H27Cl2NCAS 84485-00-7316.31 g/mol

Open in Covalent MOL file
NClHCl
Aryl halideTertiary amine

Properties

Molecular formula
C17H27Cl2N
Molar mass
316.31 g/mol
Exact mass
315.1521 Da
logP
5.16Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
5

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

Search the SDS library

Identifiers

CAS number
84485-00-7
SMILES
CC(C)CC(N(C)C)C1(c2ccc(Cl)cc2)CCC1.Cl
InChIKey
UWAOJIWUVCMBAZ-UHFFFAOYSA-N
InChI
InChI=1S/C17H26ClN.ClH/c1-13(2)12-16(19(3)4)17(10-5-11-17)14-6-8-15(18)9-7-14;/h6-9,13,16H,5,10-12H2,1-4H3;1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • Cyclobutanemethanamine, 1-(4-chlorophenyl)-N,N-dimethyl-α-(2-methylpropyl)-, hydrochloride (1:1)
  • Cyclobutanemethanamine, 1-(4-chlorophenyl)-N,N-dimethyl-α-(2-methylpropyl)-, hydrochloride
  • BTS 54524
  • Reductil
  • Vazy
  • Redulip

Work with Sibutramine hydrochloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Sibutramine hydrochloride monohydrate125494-59-9Hydrate Sibutramine106650-56-0Free base

Similar compounds

1-[1-(4-Chlorophenyl)cyclobutyl]-3-methylbutylamine hydrochloride84484-78-664 % similar 1-(4-Chlorophenyl)cyclobutanecarbonitrile28049-61-833 % similar 1-(p-Chlorophenyl)cyclobutanecarboxylic acid50921-39-632 % similar Loperamide hydrochloride34552-83-530 % similar 1-Chloro-4-(1,1-dimethylethyl)benzene3972-56-330 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook