CAS 1261230-44-7

1,1-Dimethylethyl 2-[(2-pyrimidinylamino)methyl]-1-pyrrolidinecarboxylate

Description:

1,1-Dimethylethyl 2-[(2-pyrimidinylamino)methyl]-1-pyrrolidinecarboxylate, identified by its CAS number 1261230-44-7, is a chemical compound characterized by its complex structure, which includes a pyrrolidine ring and a pyrimidine moiety. This compound typically exhibits properties associated with both amines and esters, suggesting potential solubility in polar solvents. Its molecular structure indicates the presence of functional groups that may engage in hydrogen bonding, influencing its reactivity and interaction with biological systems. The presence of the dimethyl group contributes to steric hindrance, which can affect the compound's biological activity and pharmacokinetics. Additionally, the pyrimidine ring may impart specific biological properties, making it of interest in medicinal chemistry, particularly in the development of pharmaceuticals. Overall, this compound's unique structural features suggest potential applications in drug design and development, although specific biological activities would require further investigation through experimental studies.

Formula: C₁₄H₂₂N₄O₂

InChI: InChI=1S/C14H22N4O2/c1-14(2,3)20-13(19)18-9-4-6-11(18)10-17-12-15-7-5-8-16-12/h5,7-8,11H,4,6,9-10H2,1-3H3,(H,15,16,17)

InChI key: InChIKey=OENQUELQAODRSU-UHFFFAOYSA-N

SMILES: C(NC=1N=CC=CN1)C2N(C(OC(C)(C)C)=O)CCC2

Synonyms:

• 1-Pyrrolidinecarboxylic acid, 2-[(2-pyrimidinylamino)methyl]-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl 2-[(2-pyrimidinylamino)methyl]-1-pyrrolidinecarboxylate