CAS 1353976-27-8

3-[[(1-Methylethyl)(phenylmethyl)amino]methyl]-1-piperidineacetic acid

Description:

3-[[(1-Methylethyl)(phenylmethyl)amino]methyl]-1-piperidineacetic acid, identified by its CAS number 1353976-27-8, is a chemical compound characterized by its complex structure that includes a piperidine ring and an acetic acid moiety. This substance features a tertiary amine group, which contributes to its potential as a pharmacological agent. The presence of both an isopropyl and a benzyl group enhances its lipophilicity, potentially influencing its bioavailability and interaction with biological targets. The piperidine ring provides a cyclic structure that may facilitate specific conformational properties, which are important for receptor binding. Additionally, the carboxylic acid functional group can participate in hydrogen bonding, affecting solubility and reactivity. Overall, this compound may exhibit interesting pharmacological properties, making it a candidate for further research in medicinal chemistry and drug development. However, specific biological activities, toxicity, and therapeutic applications would require detailed investigation through experimental studies.

Formula: C₁₈H₂₈N₂O₂

InChI: InChI=1S/C18H28N2O2/c1-15(2)20(12-16-7-4-3-5-8-16)13-17-9-6-10-19(11-17)14-18(21)22/h3-5,7-8,15,17H,6,9-14H2,1-2H3,(H,21,22)

InChI key: InChIKey=VMXFQPYEOVOYAS-UHFFFAOYSA-N

SMILES: C(N(CC1=CC=CC=C1)C(C)C)C2CN(CC(O)=O)CCC2

Synonyms:

• 1-Piperidineacetic acid, 3-[[(1-methylethyl)(phenylmethyl)amino]methyl]-
• 3-[[(1-Methylethyl)(phenylmethyl)amino]methyl]-1-piperidineacetic acid