N-(2-pyridylmethyl)-3-thienyl-carboxamide | 701934-42-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: N-(2-pyridylmethyl)-3-thienyl-carboxamide
• 英文别名: N-(2-pyridylmethyl)-3-thenyl-carboxamide；N-(pyridin-2-ylmethyl)-2-thiophen-3-ylacetamide
• CAS: 701934-42-1
• 化学式: C₁₂H₁₂N₂OS
• 分子量: 232.306
• InChiKey: WXDANOYHAUHRQM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  16
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  70.2
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  copper(II) perchlorate hexahydrate 、 N-(2-pyridylmethyl)-3-thienyl-carboxamide 以 乙醇 为溶剂， 以73%的产率得到bis[N-(2-pyridylmethyl)-3-thenyl carboxamide]copper(II) perchlorate
  参考文献：
  名称：

  Metal complexes of 3-thiophene carboxamides containing a pyridine ring

  摘要：

  Complexes of Zn(II), Cu(II) and Co(II) with either N-(2-methylpyridyl)-3-thienyl-alkyl-carboxamide or N-(2-pyridyl)-3-thienylalkylcarboxamide groups have been prepared and characterized. Crystal structures of ten new complexes are reported and discussed. N-(2-Methylpyridyl)-3-thienyl-alkyl-carboxamide exhibits both uni- and bidentate behavior. With all ligands, bidentate complexation is through the carbonyl oxygen and pyridine nitrogen atoms (O, N) and the amide nitrogen atom remains protonated. The electrochemical behavior and the infrared spectra of selected complexes are discussed. (C) 2007 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2007.01.003

文献信息

• Synthesis and characterization of 3-thiophene carboxamides containing a pyridine ring: structure, electrochemistry, and complexation
  作者：S. Jarrett Howell、Cynthia S. Day、Ronald E. Noftle

  DOI：10.1016/j.ica.2005.05.008

  日期：2005.9

  A series of new thiophene amides containing a pyridine ring has been synthesized and characterized. Single crystal X-ray structures have been determined for four of the new substances which show two distinct patterns of hydrogen-bonding. The crystal structure of the copper (11) complex of one of the ligands shows that the bonding is 0,N in a square planar geometry with perchlorate ions in the axial positions. The new compounds do not undergo electropolymerization due to primary oxidation of the amide function but tuning of the amide group by introduction of an electron-withdrawing group on the pyridine ring allows electropolymerization to occur. (c) 2005 Elsevier B.V. All rights reserved.
• Metal complexes of 3-thiophene carboxamides containing a pyridine ring
  作者：S. Jarrett Howell、Cynthia S. Day、Ronald E. Noftle

  DOI：10.1016/j.ica.2007.01.003

  日期：2007.5

  Complexes of Zn(II), Cu(II) and Co(II) with either N-(2-methylpyridyl)-3-thienyl-alkyl-carboxamide or N-(2-pyridyl)-3-thienylalkylcarboxamide groups have been prepared and characterized. Crystal structures of ten new complexes are reported and discussed. N-(2-Methylpyridyl)-3-thienyl-alkyl-carboxamide exhibits both uni- and bidentate behavior. With all ligands, bidentate complexation is through the carbonyl oxygen and pyridine nitrogen atoms (O, N) and the amide nitrogen atom remains protonated. The electrochemical behavior and the infrared spectra of selected complexes are discussed. (C) 2007 Elsevier B.V. All rights reserved.