N,N-二甲基-2-(2,5-二甲氧基苯基)异丙胺 | 67707-78-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: N,N-二甲基-2-(2,5-二甲氧基苯基)异丙胺
• 英文名称: N,N-dimethyl-2-(2,5-dimethoxyphenyl)isopropylamine
• 英文别名: [2-(2,5-dimethoxy-phenyl)-1-methyl-ethyl]-dimethyl-amine；[2-(2,5-Dimethoxy-phenyl)-1-methyl-aethyl]-dimethyl-amin；2-Dimethylamino-1-(2.5-dimethoxy-phenyl)-propan；2,5-dimethoxy-N,N-dimethylamphetamine；9X5L5Snc4W；1-(2,5-dimethoxyphenyl)-N,N-dimethylpropan-2-amine
• CAS: 67707-78-2
• 化学式: C₁₃H₂₁NO₂
• 分子量: 223.315
• InChiKey: AZSJYUNXTSRXEI-UHFFFAOYSA-N

物化性质

• 沸点：
  304.5±32.0 °C(Predicted)
• 密度：
  0.981±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  16
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  21.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  N,N-二甲基-2-(2,5-二甲氧基苯基)异丙胺 在 高氯酸 、 <131>ICl 作用下， 以 溶剂黄146 为溶剂， 生成 N,N-dimethyl-2-(4-<131I>iodo-2,5-dimethoxyphenyl)isopropylamine
  参考文献：
  名称：

  Radiohalogen-labeled imaging agents. 3. Compounds for measurement of brain blood flow by emission tomography

  摘要：

  The radioiodine-labeled amines currently available as brain-imaging agents, based on our previous work and that of others, are prepared either by exchange labeling or by direct iodination of a protected intermediate. The intrinsic slowness of these processes limits their potential for use with the positron-emitting 122I, as it has a half-life of only 3.6 min. This isotope has advantages of a low dose to the patient and availability from a generator containing the parent 20-h 122Xe. To develop a radiopharmaceutical in which 122I could be utilized, we prepared a number of secondary and tertiary amines (maintaining the 2,5-dimethoxy substitution pattern which allows direct iodination at the 4-position) with 131I. The organ distributions of these compounds were studied, and the best properties were found in the N,N-dimethyl homologue (2,5-dimethoxy-N,N-dimethyl-4-iodoamphetamine). This compound was successfully synthesized in a matter of seconds, with a chemical yield and radioactive purity both in excess of 90% and an incorporation efficiency of radioiodine of about 40%.

  DOI：

  10.1021/jm00374a023
• 作为产物：
  描述：

  2-烯丙基-1,4-二甲氧基苯 在 乙醇 、 氢溴酸 作用下， 生成 N,N-二甲基-2-(2,5-二甲氧基苯基)异丙胺
  参考文献：
  名称：

  Horii; Inoi, Yakugaku Zasshi/Journal of the Pharmaceutical Society of Japan, 1957, vol. 77, p. 1095,1099

  摘要：

  DOI：

文献信息

• Amines Related to 2,5-Dimethoxyphenethylamine.¹ II
  作者：Richard Baltzly、Johannes S. Buck

  DOI：10.1021/ja01858a047

  日期：1940.1
• Serotonin receptor binding affinities of several hallucinogenic phenylalkylamine and N,N-dimethyltryptamine analogs
  作者：Richard A. Glennon、Stephen M. Liebowitz、Elizabeth C. Mack

  DOI：10.1021/jm00206a022

  日期：1978.8

  Hallucinogenic phenylalkylamine and N,N-dimethyltryptamine analogues are known to affect serotonergic systems both in vivo and in vitro. Using a rat stomach fundus model, the 5-HT receptor binding affinities of several of these analogues were determined and compared. The most behaviorally potent analogues examined, DOB, DOM, and 5-methoxy-N,N-dimethyltryptamine, were found to possess rather high affirmities (pA2 = 7.35, 7.12, and 7.08, respectively) for the 5-HT receptors of the model system.
• MATHIS C. A.; SHULGIN A. T.; YANO Y.; SARGENT T. , III, APPL. RADIAT. AND ISOTOP., 37,(1986) N 8, 865-872
  作者：MATHIS C. A.、 SHULGIN A. T.、 YANO Y.、 SARGENT T. , III

  DOI：——

  日期：——
• Antiparkinsonian Action of Phenylisopropylamines
  申请人：Caron G. Marc

  公开号：US20070027208A1

  公开（公告）日：2007-02-01

  A method of treating a subject for Parkinson's disease comprises administering said subject a phenylisopropylamine in an amount effective to treat said Parkinson's disease. In some embodiments the method is used to treat at least a motor symptom of Parkinson's disease; in some embodiments the method is used to treat at least a non-motor symptom of Parkinson's disease.
• US8877802B2
  申请人：——

  公开号：US8877802B2

  公开（公告）日：2014-11-04