N-(pyridin-3-ylmethyl)furan-3-carboxamide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 呋喃
• 英文名称: N-(pyridin-3-ylmethyl)furan-3-carboxamide
• 化学式: C₁₁H₁₀N₂O₂
• mdl: MFCD11775298
• 分子量: 202.213
• InChiKey: PXFZBMJOTYYPML-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  55.1
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  3-氨甲基吡啶 、 2,2,2-三氯-1-(3-呋喃基)乙酮 以 甲醇 为溶剂， 反应 15.0h， 以92%的产率得到N-(pyridin-3-ylmethyl)furan-3-carboxamide
  参考文献：
  名称：

  Synthesis, antimicrobial activity, and QSAR studies of furan-3-carboxamides

  摘要：

  The synthesis and characterization of a new series of furan-3-carboxamides, from the aromatization of 4-trichloroacetyl-2,3-dihydrofuran to 3-trichloroacetyl furan followed by nucleophilic displacement of the trichloromethyl group or the corresponding carboxylic acid chloride by nitrogen-containing compounds, is presented. Preliminary in vitro antimicrobial activity of the title compounds was assessed against a panel of microorganisms including yeast, filamentous fungi, bacteria, and alga. Some of the furan-3-carboxamides exhibited significant in vitro antimicrobial activity. QSAR investigation was applied to find a correlation between the different physicochemical parameters of the Compounds studied and their biological activity. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2007.01.003