1-(3-Hydroxymethyl-2-pyridyl)-4-methyl-2-phenylpiperazine

C₁₇H₂₁N₃OCAS 61337-89-1283.38 g/mol

Open in Covalent MOL file

Alcohol Tertiary amine

Properties

Molecular formula: C₁₇H₂₁N₃O
Molar mass: 283.38 g/mol
Exact mass: 283.1685 Da
Melting point: 124–125 °C
logP: 2.07Crippen estimate
Polar surface area: 39.6 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 3

Identifiers

CAS number

61337-89-1

SMILES

CN1CCN(c2ncccc2CO)C(c2ccccc2)C1

InChIKey

PYZPABZGIRHQTA-UHFFFAOYSA-N

InChI

InChI=1S/C17H21N3O/c1-19-10-11-20(17-15(13-21)8-5-9-18-17)16(12-19)14-6-3-2-4-7-14/h2-9,16,21H,10-13H2,1H3

Weigh it out

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

Names and synonyms

4 names

3-Pyridinemethanol, 2-(4-methyl-2-phenyl-1-piperazinyl)-
2-(4-Methyl-2-phenyl-1-piperazinyl)-3-pyridinemethanol
1-[3-(Hydroxymethyl)pyridin-2-yl)-4-methyl-2-phenylpiperazine
2-(4-Methyl-2-phenylpiperazin-1-yl)pyridine-3-methanol

Work with 1-(3-Hydroxymethyl-2-pyridyl)-4-methyl-2-phenylpiperazine

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-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine61338-13-463 % similar Mirtazapine61337-67-562 % similar Mirtazapine85650-52-862 % similar [2-(4-Methylpiperazin-1-yl)phenyl]methanol123987-12-240 % similar Mianserin hydrochloride21535-47-739 % similar 2-(Methylamino)-3-pyridinemethanol32399-12-536 % similar 2-Methoxy-3-pyridinemethanol112197-16-735 % similar 1-Methyl-3-phenylpiperidine19509-11-635 % similar

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

Same formula

4-[4-(4-Methoxyphenyl)-1-piperazinyl]benzenamine74852-62-3

Elsewhere

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