1-(4-Methyl-2-pyridinyl)piperazine

C₁₀H₁₅N₃CAS 34803-67-3177.25 g/mol

Open in Covalent MOL file

Secondary amine Tertiary amine

Properties

Molecular formula: C₁₀H₁₅N₃
Molar mass: 177.25 g/mol
Exact mass: 177.1266 Da
logP: 0.80Crippen estimate
Polar surface area: 28.2 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed16.7% of notifiers
H312 Harmful in contact with skin16.7% of notifiers
H314 Causes severe skin burns and eye damage83.3% of notifiers
H332 Harmful if inhaled16.7% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, P501

Identifiers

CAS number

34803-67-3

SMILES

Cc1ccnc(N2CCNCC2)c1

InChIKey

ZFBRKSGGMODDHD-UHFFFAOYSA-N

InChI

InChI=1S/C10H15N3/c1-9-2-3-12-10(8-9)13-6-4-11-5-7-13/h2-3,8,11H,4-7H2,1H3

Weigh it out

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

Names and synonyms

4 names

Piperazine, 1-(4-methyl-2-pyridinyl)-
Piperazine, 1-(4-methyl-2-pyridyl)-
1-(4-Methyl-2-pyridyl)piperazine
1-(4-Methylpyridin-2-yl)piperazine

Work with 1-(4-Methyl-2-pyridinyl)piperazine

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

Pyridinylpiperazine34803-66-254 % similar 1-(2,4-Dimethylphenyl)piperazine1013-76-954 % similar 1-(3-Methylphenyl)piperazine41186-03-251 % similar 1-(2,5-Dimethylphenyl)piperazine1013-25-850 % similar 1-(2-Pyridyl)piperazine monohydrochloride129394-11-250 % similar 1-Piperazinylpyrazine34803-68-450 % similar 1-(p-Tolyl)piperazine39593-08-349 % similar 1-(3-Methylphenyl)piperazine dihydrochloride13078-13-248 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-[(Pyridin-3-yl)methyl]piperazine39244-80-9 1-Pyridin-2-ylmethyl-piperazine55579-01-6 1-((Pyridin-4-yl)methyl)piperazine62089-74-1

Elsewhere

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