2-(2-Chloroethyl)-1-methylpiperidine hydrochloride

C₈H₁₇Cl₂NCAS 58878-37-8198.13 g/mol

Open in Covalent MOL file

Alkyl halide Tertiary amine

Properties

Molecular formula: C₈H₁₇Cl₂N
Molar mass: 198.13 g/mol
Exact mass: 197.0738 Da
Melting point: 132–133 °C
logP: 2.52Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 2

Identifiers

CAS number

58878-37-8

SMILES

CN1CCCCC1CCCl.Cl

InChIKey

WVBKLELBSWJXAT-UHFFFAOYSA-N

InChI

InChI=1S/C8H16ClN.ClH/c1-10-7-3-2-4-8(10)5-6-9;/h8H,2-7H2,1H3;1H

Weigh it out

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

Names and synonyms

2 names

Piperidine, 2-(2-chloroethyl)-1-methyl-, hydrochloride (1:1)
Piperidine, 2-(2-chloroethyl)-1-methyl-, hydrochloride

Work with 2-(2-Chloroethyl)-1-methylpiperidine 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

Similar compounds

2-(2-Chloroethyl)-N-methylpyrrolidine hydrochloride56824-22-789 % similar 1-Methyl-2-piperidinemethanol20845-34-550 % similar 2-(2-Aminoethyl)-1-methylpyrrolidine51387-90-745 % similar 1-Methyl-2-pyrrolidineethanol67004-64-245 % similar (2S)-1-Methyl-2-pyrrolidinemethanol34381-71-042 % similar 1-Methyl-2-pyrrolidinemethanol3554-65-242 % similar 3-Dimethylaminopropyl chloride hydrochloride1281-00-141 % similar 3-(Dimethylamino)propyl chloride hydrochloride5407-04-541 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

β-(Hexahydro-1H-azepin-1-yl)ethyl chloride hydrochloride26487-67-2

Elsewhere

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