Piribedil

C₁₆H₁₈N₄O₂CAS 3605-01-4298.35 g/mol

Open in Covalent MOL file

Acetal Ether Tertiary amine

Properties

Molecular formula: C₁₆H₁₈N₄O₂
Molar mass: 298.35 g/mol
Exact mass: 298.1430 Da
Melting point: 98 °C
logP: 1.53Crippen estimate
Polar surface area: 50.7 Å²
H-bond donors / acceptors: 0 / 6
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H336 May cause drowsiness or dizziness50% of notifiers
H362 May cause harm to breast-fed children50% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure50% of notifiers
H412 Harmful to aquatic life with long lasting effects50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P261, P263, P264, P270, P271, P273, P301+P317, P304+P340, P318, P319, P330, P403+P233, P405, P501

Identifiers

CAS number

3605-01-4

SMILES

c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1

InChIKey

OQDPVLVUJFGPGQ-UHFFFAOYSA-N

InChI

InChI=1S/C16H18N4O2/c1-4-17-16(18-5-1)20-8-6-19(7-9-20)11-13-2-3-14-15(10-13)22-12-21-14/h1-5,10H,6-9,11-12H2

Weigh it out

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

Names and synonyms

12 names

Pyrimidine, 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-
Pyrimidine, 2-(4-piperonyl-1-piperazinyl)-
2-[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]pyrimidine
1-(2-Pyrimidyl)-4-piperonylpiperazine
4-[3,4-(Methylenedioxy)benzyl]-1-(2-pyrimidinyl)piperazine
ET 495
Trivastal
1-(2-Pyrimidyl)-4-(3,4-methylenedioxybenzyl)piperazine
Trivastan
EU 4200
Pronoran
2-(4-(Benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)pyrimidine

Work with Piribedil

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-Piperonylpiperazine32231-06-456 % similar Fipexide34161-24-543 % similar 1,3-Benzodioxole-5-ethanamine1484-85-141 % similar Piperonyl chloride20850-43-540 % similar Benzo-1,3-dioxole-5-methylamine2620-50-040 % similar Piperonyl alcohol495-76-140 % similar 3,4-Methylenedioxy-β-phenylethylamine hydrochloride1653-64-138 % similar Pyrimidinylpiperazine20980-22-737 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook