1,2,5-三甲基-4-苯基哌啶-4-醇 | 562-11-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 中文名称: 1,2,5-三甲基-4-苯基哌啶-4-醇
• 英文名称: 1,2,5-trimethyl-4-phenyl-piperidin-4-ol
• 英文别名: 1,2,5-Trimethyl-4-phenylpiperidin-4-ol
• CAS: 562-11-8
• 化学式: C₁₄H₂₁NO
• mdl: MFCD00452224
• 分子量: 219.327
• InChiKey: CTKBMLDLEZVLNP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  23.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1,2,5-三甲基-4-苯基哌啶-4-醇 在 盐酸 作用下， 反应 4.0h， 生成 1,2,5-trimethyl-4-phenyl-1,2,3,6-tetrahydro-pyridine 、 1,3,6-trimethyl-4-phenyl-1,2,3,6-tetrahydropyridine
  参考文献：
  名称：

  Synthesis and toxicity toward nigrostriatal dopamine neurons of 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine (MPTP) analogs

  摘要：

  Six compounds having structural features in common with 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine (MPTP) were synthesized and tested in mice for the ability to produce a prolonged decrease in nigrostriatal dopamine (DA) and DA metabolites. The compounds that were prepared and tested include the ester elimination products of the analgetic drugs alpha-prodine and trimeperidine. None of the compounds in this study, except for MPTP, produced significant neurotoxic effects in the mouse model. The study shows that minor changes in the tetrahydropyridine ring of MPTP result in a marked decrease in neurotoxicity.

  DOI：

  10.1021/jm00153a019

文献信息

• Synthesis of substituted 4-acetylamino-4-phenylpiperidines from the corresponding 4-piperidols under Ritter reaction conditions
  作者：T. D. Sokolova、G. V. Cherkaev、I. P. Boiko、A. S. Moskovkin

  DOI：10.1007/bf02291798

  日期：1997.6
• Synthesis and structure of 1-benzoyl-2,5-dimethyl- and 1,2,5-trimethyl-4-arylpiperideins
  作者：T. N. Borisova、N. D. Sergeeva、A. A. Espenbetov、D. S. Yufit、A. V. Varlamov、I. V. Eliseeva、N. S. Prostakov

  DOI：10.1007/bf00478127

  日期：1986.9
• FRIES, D. S.;VRIES, J. DE;HAZELHOFF, B.;HORN, A. S., J. MED. CHEM., 1986, 29, N 3, 424-427
  作者：FRIES, D. S.、VRIES, J. DE、HAZELHOFF, B.、HORN, A. S.

  DOI：——

  日期：——
• BORISOVA T. N.; SERGEEVA N. D.; ESPENBETOV A. A.; YUFIT D. S.; VARLAMOV A+, XIMIYA GETEROTSIKL. SOED.,(1986) N 9, 1200-1206
  作者：BORISOVA T. N.、 SERGEEVA N. D.、 ESPENBETOV A. A.、 YUFIT D. S.、 VARLAMOV A+

  DOI：——

  日期：——
• PROSTAKOV N. S.; MIXAJLOVA N. M.; BACKEC ISMAEHL R., XIM.-FARMATSEVT. ZH., 1977, 11, HO 5, 104-106
  作者：PROSTAKOV N. S.、 MIXAJLOVA N. M.、 BACKEC ISMAEHL R.

  DOI：——

  日期：——