1-(2-Methoxyphenyl)piperazine hydrochloride

C₁₁H₁₇ClN₂OCAS 5464-78-8228.72 g/mol

Open in Covalent MOL file

Ether Secondary amine Tertiary amine

Properties

Molecular formula: C₁₁H₁₇ClN₂O
Molar mass: 228.72 g/mol
Exact mass: 228.1029 Da
Melting point: 236–238 °C
logP: 1.53Crippen estimate
Polar surface area: 24.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

Identifiers

CAS number

5464-78-8

SMILES

COc1ccccc1N1CCNCC1.Cl

InChIKey

DDMVHGULHRJOEC-UHFFFAOYSA-N

InChI

InChI=1S/C11H16N2O.ClH/c1-14-11-5-3-2-4-10(11)13-8-6-12-7-9-13;/h2-5,12H,6-9H2,1H3;1H

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

Names and synonyms

5 names

Piperazine, 1-(2-methoxyphenyl)-, hydrochloride (1:1)
Piperazine, 1-(2-methoxyphenyl)-, monohydrochloride
1-(2-Methoxyphenyl)piperazine monohydrochloride
4-(2-Methoxyphenyl)piperazine hydrochloride
1-(2-Methoxyphenyl)piperazin-1-ium chloride

Work with 1-(2-Methoxyphenyl)piperazine 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

1-(2-Methoxyphenyl)piperazine35386-24-490 % similar 1-(2-Methoxyphenyl)piperazine hydrobromide100939-96-682 % similar 1-(2-Ethoxyphenyl)piperazine hydrochloride83081-75-873 % similar 1-(2-Ethoxyphenyl)piperazine13339-01-065 % similar 1-(3,4-Dimethoxyphenyl)piperazine hydrochloride16015-72-859 % similar 1-(2-Fluorophenyl)piperazine hydrochloride1011-16-155 % similar N-(2-Chlorophenyl)piperazine monohydrochloride41202-32-855 % similar N-(4-Methoxyphenyl)piperazine dihydrochloride38869-47-554 % similar

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

Same formula

1-(4-Methoxyphenyl)piperazine hydrochloride84145-43-7

Elsewhere

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