chempirical

1-(2-Pyridyl)piperazine monohydrochloride

C9H14ClN3CAS 129394-11-2199.68 g/mol

Open in Covalent MOL file
NHNNHCl
Secondary amineTertiary amine

Properties

Molecular formula
C9H14ClN3
Molar mass
199.68 g/mol
Exact mass
199.0876 Da
logP
0.91Crippen estimate
Polar surface area
28.2 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
129394-11-2
SMILES
C1CN(CCN1)C2=CC=CC=N2.Cl
InChIKey
XQVSONPKJXNWJO-UHFFFAOYSA-N
InChI
InChI=1S/C9H13N3.ClH/c1-2-4-11-9(3-1)12-7-5-10-6-8-12;/h1-4,10H,5-8H2;1H

Weigh it out

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

Work with 1-(2-Pyridyl)piperazine monohydrochloride

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

Pyridinylpiperazine34803-66-289 % similar 2-(1-Piperazinyl)pyrimidine dihydrochloride94021-22-461 % similar 1-Phenylpiperazine hydrochloride2210-93-755 % similar Pyrimidinylpiperazine20980-22-752 % similar 2-(1-Piperazinyl)pyrazine34803-68-451 % similar Tripelennamine hydrochloride154-69-850 % similar 1-(4-Methyl-2-pyridinyl)piperazine34803-67-350 % similar 1-(2-Fluorophenyl)piperazine hydrochloride1011-16-147 % similar

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

Elsewhere

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