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CAS 864069-00-1

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2-[(4-methylpiperazin-1-yl)methyl]benzonitrile

Description:
2-[(4-methylpiperazin-1-yl)methyl]benzonitrile, with the CAS number 864069-00-1, is a chemical compound characterized by its structure, which includes a benzonitrile moiety and a piperazine ring. This compound features a piperazine group substituted with a methyl group at the 4-position, linked to a benzene ring that is further substituted with a nitrile group. The presence of the nitrile functional group contributes to its polarity and potential reactivity, while the piperazine ring can influence its biological activity and solubility. Typically, compounds like this may exhibit properties such as moderate to high solubility in polar solvents and may engage in hydrogen bonding due to the nitrogen atoms in the piperazine. Its structural characteristics suggest potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, where such compounds may serve as intermediates or active pharmaceutical ingredients. The specific biological activity and pharmacokinetic properties would depend on further studies and characterization.
Formula:C13H17N3
InChI:InChI=1/C13H17N3/c1-15-6-8-16(9-7-15)11-13-5-3-2-4-12(13)10-14/h2-5H,6-9,11H2,1H3
SMILES:CN1CCN(CC1)Cc1ccccc1C#N
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