Arrangement of Azidomethyl Group in Lupinine Azide: Structural and Spectroscopic Properties.

ABSTRACT: Quinolizidine derivatives are an important class of substances that are used in the pharmaceutical industry. In previous studies, the synthesis of these substances is carried out using lupinine azide (IUPAC: 1-(azidomethyl)octahydro-2H-quinolizine), which is often used to obtain new biologically active compounds. In this regard, its structural characterization is critically important. In this work, the conformational diversity of the molecular structure of this compound has been studied. It is shown that the structure with the axial position of the methyl azide group contains a number of low-energy conformer states with energies higher than the ground state by 0.15-0.60 kcal/mol. Such structural ambiguity should manifest itself in the chemical reactions and biological activity of lupinine

SUBMITTER: Kopbalina K 

PROVIDER: S-EPMC11820821 | biostudies-literature | 2025 Jan

REPOSITORIES: biostudies-literature