1-(3-Methoxyphenyl)piperazine dihydrochloride

C₁₁H₁₈Cl₂N₂OCAS 6968-76-9265.18 g/mol

Open in Covalent MOL file

Ether Secondary amine Tertiary amine

Properties

Molecular formula: C₁₁H₁₈Cl₂N₂O
Molar mass: 265.18 g/mol
Exact mass: 264.0796 Da
logP: 1.95Crippen estimate
Polar surface area: 24.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

Identifiers

CAS number

6968-76-9

SMILES

COc1cccc(N2CCNCC2)c1.Cl.Cl

InChIKey

UKUNKQNESKRETR-UHFFFAOYSA-N

InChI

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

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

Names and synonyms

3 names

Piperazine, 1-(3-methoxyphenyl)-, hydrochloride (1:2)
Piperazine, 1-(3-methoxyphenyl)-, dihydrochloride
4-(3-Methoxyphenyl)piperazine dihydrochloride

Work with 1-(3-Methoxyphenyl)piperazine dihydrochloride

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-(3-Methoxyphenyl)piperazine16015-71-791 % similar 1-(4-Methoxyphenyl)piperazine hydrochloride84145-43-768 % similar 1-(3,4-Dimethoxyphenyl)piperazine hydrochloride16015-72-864 % similar 1-(3-Methylphenyl)piperazine dihydrochloride13078-13-262 % similar 1-(3-Chlorophenyl)piperazine hydrochloride13078-15-461 % similar 1-(3-Chlorophenyl)piperazine dihydrochloride51639-49-761 % similar Piperazine, 1-(3-chlorophenyl)-, hydrochloride (1:?)65369-76-861 % similar 1-(4-Methoxyphenyl)piperazine38212-30-559 % similar

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

Same formula

N-(4-Methoxyphenyl)piperazine dihydrochloride38869-47-5

Elsewhere

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