CAS 1240526-65-1

1-(2-Piperidinylmethyl)-4-(trifluoromethyl)-1H-pyrrole-3-carboxylic acid

Description:

1-(2-Piperidinylmethyl)-4-(trifluoromethyl)-1H-pyrrole-3-carboxylic acid is a chemical compound characterized by its unique structural features, which include a pyrrole ring substituted with a trifluoromethyl group and a piperidinylmethyl side chain. This compound is notable for its potential biological activity, often explored in medicinal chemistry for its role as a pharmacophore in drug development. The presence of the trifluoromethyl group enhances lipophilicity and metabolic stability, which can influence the compound's pharmacokinetic properties. Additionally, the carboxylic acid functional group contributes to its acidity and potential interactions with biological targets. The piperidine moiety may also play a role in receptor binding and selectivity. Overall, this compound's characteristics make it a subject of interest in the synthesis of novel therapeutic agents, particularly in the fields of neuroscience and pharmacology. Its specific interactions and efficacy would depend on further empirical studies and evaluations.

Formula: C₁₂H₁₅F₃N₂O₂

InChI: InChI=1S/C12H15F3N2O2/c13-12(14,15)10-7-17(6-9(10)11(18)19)5-8-3-1-2-4-16-8/h6-8,16H,1-5H2,(H,18,19)

InChI key: InChIKey=UQHODNJCIKJHTH-UHFFFAOYSA-N

SMILES: C(N1C=C(C(F)(F)F)C(C(O)=O)=C1)C2CCCCN2

Synonyms:

• 1-(2-Piperidinylmethyl)-4-(trifluoromethyl)-1H-pyrrole-3-carboxylic acid
• 1H-Pyrrole-3-carboxylic acid, 1-(2-piperidinylmethyl)-4-(trifluoromethyl)-