CAS 1131622-64-4

Methyl 2-[(2-methyl-1-piperazinyl)methyl]benzoate

Description:

Methyl 2-[(2-methyl-1-piperazinyl)methyl]benzoate, identified by its CAS number 1131622-64-4, is a chemical compound characterized by its ester functional group, which is derived from benzoic acid and methanol. This compound features a piperazine ring, which contributes to its potential biological activity and pharmacological properties. The presence of the methyl group on the piperazine enhances its lipophilicity, potentially influencing its interaction with biological membranes. Methyl 2-[(2-methyl-1-piperazinyl)methyl]benzoate is typically a white to off-white solid, and its solubility can vary depending on the solvent used, often being more soluble in organic solvents than in water. The compound may exhibit various properties such as moderate stability under standard conditions, and it may be sensitive to light or moisture. Its structural characteristics suggest potential applications in medicinal chemistry, particularly in the development of pharmaceuticals targeting central nervous system disorders, given the piperazine moiety's common use in drug design.

Formula: C₁₄H₂₀N₂O₂

InChI: InChI=1S/C14H20N2O2/c1-11-9-15-7-8-16(11)10-12-5-3-4-6-13(12)14(17)18-2/h3-6,11,15H,7-10H2,1-2H3

InChI key: InChIKey=RTTSGIMGUPFARD-UHFFFAOYSA-N

SMILES: C(C1=C(C(OC)=O)C=CC=C1)N2C(C)CNCC2

Synonyms:

• Methyl 2-[(2-methyl-1-piperazinyl)methyl]benzoate
• Benzoic acid, 2-[(2-methyl-1-piperazinyl)methyl]-, methyl ester