Adamantan-1-yl-pyridin-4-yl-amine

• 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: Adamantan-1-yl-pyridin-4-yl-amine
• 英文别名: N-(1-adamantyl)pyridin-4-amine
• 化学式: C₁₅H₂₀N₂
• 分子量: 228.337
• InChiKey: ZGZHODNLBJGYGZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  24.9
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  4-氯苄溴 、 Adamantan-1-yl-pyridin-4-yl-amine 以 甲苯 为溶剂， 反应 4.0h， 以84%的产率得到
  参考文献：
  名称：

  Exploring a pocket for polycycloaliphatic groups in the CXCR3 receptor with the aid of a modular synthetic strategy

  摘要：

  A CXCR3 pocket capable of accommodating polycycloaliphatics was explored using a modular synthetic strategy. The systematic studies reveal that the tricyclic 2-adamantane and bicyclic (iso) bornyl group are efficiently recognized by CXCR3. (c) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.02.093
• 作为产物：
  描述：

  4-氨基吡啶 、 1-金刚烷醇 在 三氟乙酸 作用下， 反应 5.0h， 以50%的产率得到Adamantan-1-yl-pyridin-4-yl-amine
  参考文献：
  名称：

  Adamantylaminopyrimidines and -pyridines are potent inducers of tumor necrosis factor-α

  摘要：

  A series of (1-adamantyl)aminopyrimidine and -pyridine derivatives was prepared by adamantyl cation attack on amino heterocycles. The adamantylated compounds. particularly 2-(1-adamantyl)amino-6-methylpyridine, were found to be potent TNF-alpha inducers in murine melanoma cells transduced with gene for human TNF-alpha. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00174-3

文献信息

• [EN] (1-ADAMANTYLAMINO)PYRIDINES AND METHOD OF THEIR PREPARATION<br/>[FR] (1-ADAMANTYLAMINO)PYRIDINES ET PROCEDE DE PREPARATION ASSOCIE
  申请人：FUNDACJA ROZWOJU DIAGNOSTYKI I

  公开号：WO2001074778A1

  公开（公告）日：2001-10-11

  New (1-adamantylamino)pyridines of formula (2) wherein substituents R1, R2, R3, R4 or R5 are adamantylamino group, hydrogen atom, methyl group or halogen atom, the molecule of formula (2) containing one adamantylamino group and a substituent or substituents being methyl groups or halogen atoms at a position different from an-ortho position to the amino group, and the method of preparation of the new compounds. Studies have shown that these compounds stimulate secretion of TNF-α in some neoplastic cell lines.