Crystal and molecular structures of 1-[3-(3,4-dimethoxyphenyl)-2-propenoyl]pyrrolidine

Anal Sci. 2003 Sep;19(9):1347-8. doi: 10.2116/analsci.19.1347.

Abstract

The crystal structure of 1-[3-(3,4-dimethoxyphenyl)-2-propenoyl]pyrrolidine (C15H19NO3) (I) has been determined by X-ray analysis. It crystallizes orthorhombic space group Pbca with a = 24.295(3), b = 15.086(3), c = 7.552(3)A, V = 2768(1)A3, Z = 8, Dcalc = 1.254 g/cm3, mu = (Mo K(alpha)) = 0.87 cm(-1). The title compound has analgesic activity of cycloaliphatic amine part. The molecule is deviated from planar configuration.

MeSH terms

  • Anti-Inflammatory Agents, Non-Steroidal / chemistry*
  • Crystallography, X-Ray
  • Molecular Structure
  • Pyrrolidines / chemistry*

Substances

  • 1-(3-(3,4-dimethoxyphenyl)-2-propenoyl)pyrrolidine
  • Anti-Inflammatory Agents, Non-Steroidal
  • Pyrrolidines