Lorcaserin

C₁₁H₁₄ClNCAS 616202-92-7195.69 g/mol

Open in Covalent MOL file

Aryl halide Secondary amine

Properties

Molecular formula: C₁₁H₁₄ClN
Molar mass: 195.69 g/mol
Exact mass: 195.0815 Da
logP: 2.59Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0
Stereocentres: Rin SMILES atom order

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H400 Very toxic to aquatic life100% of notifiers
H410 Very toxic to aquatic life with long lasting effects100% of notifiers

Aggregated from 38 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P273, P301+P317, P330, P391, P501

Identifiers

CAS number

616202-92-7

SMILES

C[C@H]1CNCCc2ccc(Cl)cc21

InChIKey

XTTZERNUQAFMOF-QMMMGPOBSA-N

InChI

InChI=1S/C11H14ClN/c1-8-7-13-5-4-9-2-3-10(12)6-11(8)9/h2-3,6,8,13H,4-5,7H2,1H3/t8-/m0/s1

Weigh it out

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

Names and synonyms

6 names

(1R)-8-Chloro-2,3,4,5-tetrahydro-1-methyl-1H-3-benzazepine
1H-3-Benzazepine, 8-chloro-2,3,4,5-tetrahydro-1-methyl-, (1R)-
(R)-8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine
Belviq
(R)-Lorcaserin
(R)-8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine

Work with Lorcaserin

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.

Lorcaserin hydrochloride846589-98-8Salt 8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine hydrochloride1431697-94-7Salt, stereo not defined

Similar compounds

5-Chloroindoline25658-80-440 % similar (2,4-Dichlorobenzyl)methylamine5013-77-435 % similar 1-(2,4-Dichlorobenzyl)piperazine51619-56-835 % similar 3-Chloroiminodibenzyl32943-25-234 % similar 2-((1R)-1-Aminoethyl)-4-chlorophenol1228571-53-633 % similar 7-Chloro-1,2,3,4-tetrahydronaphthalen-1-one26673-32-533 % similar (2,4-Dichlorobenzyl)methylamine hydrochloride90389-07-433 % similar 1-Methyl-1,2,3,4-tetrahydroisoquinoline4965-09-733 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepine hydrochloride230615-52-8 Pargyline hydrochloride306-07-0 4-Phenyl-1,2,5,6-tetrahydropyridine hydrochloride43064-12-6

Elsewhere

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