Tiletamine hydrochloride

C₁₂H₁₈ClNOSCAS 14176-50-2259.79 g/mol

Open in Covalent MOL file

Ketone Secondary amine

Properties

Molecular formula: C₁₂H₁₈ClNOS
Molar mass: 259.79 g/mol
Exact mass: 259.0798 Da
logP: 3.12Crippen estimate
Polar surface area: 29.1 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 3

Hazards

Warning

H336 May cause drowsiness or dizziness100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P271, P304+P340, P319, P403+P233, P405, P501

Identifiers

CAS number

14176-50-2

SMILES

CCNC1(c2cccs2)CCCCC1=O.Cl

InChIKey

ZUYKJZQOPXDNOK-UHFFFAOYSA-N

InChI

InChI=1S/C12H17NOS.ClH/c1-2-13-12(11-7-5-9-15-11)8-4-3-6-10(12)14;/h5,7,9,13H,2-4,6,8H2,1H3;1H

Weigh it out

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

Names and synonyms

8 names

Cyclohexanone, 2-(ethylamino)-2-(2-thienyl)-, hydrochloride (1:1)
Cyclohexanone, 2-(ethylamino)-2-(2-thienyl)-, hydrochloride
2-(Ethylamino)-2-(2-thienyl)cyclohexanone hydrochloride
CI 634
Tiletamin hydrochloride
CL 399
CN 54521-2
NSC 167740

Work with Tiletamine 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.

Tiletamine14176-49-9Free base

Similar compounds

Deschloroketamine hydrochloride4631-27-049 % similar Ketamine hydrochloride1867-66-945 % similar (R)-(+)-Ketamine hydrochloride33795-24-345 % similar 2-(2-Fluorophenyl)-2-(methylamino)cyclohexanone111982-50-439 % similar 2-Octanoylthiophene30711-41-233 % similar 3-Dimethylamino-1-(2-thienyl)-1-propanone hydrochloride5424-47-533 % similar 2-n-Butyl-2-methylcyclohexanone1197-78-032 % similar 2-Chloro-2-methylcyclohexan-1-one10409-46-832 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook