CAS 938458-92-5

1-[(3,4-Dimethylphenyl)methyl]-2-piperazinone

Description:

1-[(3,4-Dimethylphenyl)methyl]-2-piperazinone, identified by its CAS number 938458-92-5, is a chemical compound characterized by its piperazinone core structure, which is a cyclic amine featuring a ketone functional group. This compound exhibits a molecular structure that includes a piperazine ring substituted with a 3,4-dimethylphenylmethyl group, contributing to its unique properties. The presence of the dimethylphenyl group enhances its lipophilicity, potentially influencing its biological activity and solubility in organic solvents. As a piperazinone derivative, it may exhibit pharmacological properties, making it of interest in medicinal chemistry. The compound's stability, reactivity, and potential interactions with biological targets can be influenced by the electronic and steric effects of the substituents on the aromatic ring. Additionally, its synthesis and characterization would typically involve standard organic chemistry techniques, including NMR and mass spectrometry for structural confirmation. Overall, this compound represents a class of molecules that may have applications in drug development or as intermediates in organic synthesis.

Formula: C₁₃H₁₈N₂O

InChI: InChI=1S/C13H18N2O/c1-10-3-4-12(7-11(10)2)9-15-6-5-14-8-13(15)16/h3-4,7,14H,5-6,8-9H2,1-2H3

InChI key: InChIKey=JDQLCQPPLOATHR-UHFFFAOYSA-N

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

Synonyms:

• 1-[(3,4-Dimethylphenyl)methyl]-2-piperazinone
• 2-Piperazinone, 1-[(3,4-dimethylphenyl)methyl]-

1-(3,4-dimethylbenzyl)piperazin-2-one

CAS: 938458-92-5

Formula: C₁₃H₁₈N₂O

Purity: 95.0%

Molecular weight: 218.3

Ref: 10-F308466