乙基3-氮杂双环[3.1.0]己烷-2-羧酸酯 | 75715-99-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 乙基3-氮杂双环[3.1.0]己烷-2-羧酸酯
• 英文名称: trans 2-ethoxycarbonyl-3-azabicyclo(3.1.0)hexane
• 英文别名: Ethyl 3-azabicyclo[3.1.0]hexane-2-carboxylate
• CAS: 75715-99-0
• 化学式: C₈H₁₃NO₂
• 分子量: 155.197
• InChiKey: QJFZMDWMBRUEMA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  11
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  38.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  乙基3-氮杂双环[3.1.0]己烷-2-羧酸酯 在 盐酸 、 ammonium hydroxide 、 sodium hydroxide 作用下， 以 OH- 、 水 为溶剂， 生成 cis 2-carboxy-3-azabicyclo(3.1.0)hexane (methanoproline)
  参考文献：
  名称：

  Esters of 2-carboxy-3-azabicyclo-(3.1.0)hex-2-ene

  摘要：

  2-羧基-3-氮杂双环[3.1.0]己-2-烯的酯类，可用作甲基丙氨酸顺反异构体的中间体，以及作为抑制谷物花粉形成的抑制剂。

  公开号：

  US04249936A1

文献信息

• TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES
  申请人：AbbVie Inc.

  公开号：US20140080816A1

  公开（公告）日：2014-03-20

  The present invention relates to tricyclic quinoline and quinoxaline derivatives, to a pharmaceutical composition containing such compounds, to their use as modulators, especially agonists or partial agonists, of the 5-HT 2C receptor, their use for preparing a medicament for the prevention or treatment of conditions and disorders which respond to the modulation of 5-HT 2C receptor, and to a method for preventing or treating conditions and disorders which respond to the modulation of 5-HT 2C receptor.

  本发明涉及三环喹啉和喹噁啉衍生物，以及含有这些化合物的药物组合物，它们的用途为5-HT2C受体的调节剂，特别是激动剂或部分激动剂，用于制备用于预防或治疗对5-HT2C受体调节有反应的病症和疾病的药物，以及用于预防或治疗对5-HT2C受体调节有反应的病症和疾病的方法。
• A process for the preparation of 3-azabicyclo(3.1.0)hexane derivatives and modifications thereof
  申请人：SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V.

  公开号：EP0010799A1

  公开（公告）日：1980-05-14

  2-cyano-3-azabicyclo[3.1.0]hexane, useful as an intermediate in the preparation of the corresponding acid, and certain derivatives thereof, may be prepared by reacting a compound of the general formula (II) and/or the trimer thereof: in which R' represents a hydrogen atom or an alkyl group which may be substituted by 1 or more alkoxy groups, and each of R2 to R7 represents a hydrogen atom or an alkyl, aryl, aralkyl or alkaryl group which may be substituted by one or more alkoxy groups, with a cyanide of the formula XCN in which X represents a hydrogen atom, an organic acyl group or a trialkylsilyl group. Certain of the derivatives prepared are novel. Besides that there is described the preparation of the compound of the general formula (II) and/or the trimer thereof from a compound of the general formula and the preparation of acids of the general formula (VII) or a salt and/or an ester thereof characterised in hydrolysing and/or alkoholysing a compound of the general formula in the formulas (III), (VII) and (I) the substituents R1―R7 have the same meaning as given for the formula (II); in the formula (I) X represents a hydrogen atom, an organic acyl group or a trialkylsilyl group. As already mentioned certain compounds of the formula (I) are novel.

  2-氰基-3-氮杂双环[3.1.0]己烷可作为制备相应酸的中间体，其某些衍生物可通过与通式 (II) 的化合物和/或其三聚体反应制备： 其中 R'代表氢原子或可被一个或多个烷氧基取代的烷基，R2 至 R7 各代表氢原子或可被一个或多个烷氧基取代的烷基、芳基、芳烷基或烷芳基，与式 XCN 的氰化物反应，其中 X 代表氢原子、有机酰基或三烷基硅烷基。所制备的某些衍生物具有新颖性。此外，还介绍了用通式化合物制备通式（II）化合物和/或其三聚体的方法 以及通式 (VII) 酸或其盐和/或酯的制备方法 其特征在于水解和/或碱解通式化合物 在式 (III)、(VII) 和 (I) 中，取代基 R1-R7 的含义与式 (II) 相同；在式 (I) 中，X 代表氢原子、有机酰基或三烷基硅基。如前所述，式 (I) 中的某些化合物是新颖的。
• 3-Azabicyclo(3.1.0)hexane derivatives, a process for their preparation, biologically active compositions containing them and herbicidal method using them
  申请人：SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V.

  公开号：EP0004107A1

  公开（公告）日：1979-09-19

  Novel compounds of the general formula: wherein R represents a hydrogen atom or an alkoxycarbonyl, alkyl or cycloalkyl group which may be unsubstituted or substituted by one or more of the same or different substituents selected from halogen atoms, alkoxy groups and aryl groups; R' represents a hydrogen atom or an alkyl orcyc- loalkyl group which may be unsubstituted or substituted by one or more of the same or different substituents selected from halogen atoms and alkoxy groups; and each of R2, R', R4, R5, R6 and R7 independently represents a hydrogen or halogen atom or an alkyl, cycloalkyl, alkenyl, aryl, alkaryl or aralkyl group which may be unsubstituted or substituted by one or more of the same or different substituents selected from halogen atoms and alkoxy groups, or each of R2, R3, R6, and R7 independently has one of the above meanings and R4 and R'together represent an alkylene group or each of R2, R3, R4 and R5 has one of the above meanings and R6 and R7 together represent an alkylene group; or an acid addition salt thereof.

  通式如下的新型化合物 其中 R 代表氢原子或烷氧基羰基、烷基或环烷基，它们可以未被取代或被一个或多个相同或不同的选自卤素原子、烷氧基和芳基的取代基取代；R'代表氢原子或烷基或环烷基，它们可以未被取代或被一个或多个相同或不同的选自卤素原子和烷氧基的取代基取代；R2、R'、R4、R5、R6 和 R7 中的每一个独立地代表氢原子或卤素原子或烷基、环烷基、烯基、芳基、烷芳基或芳烷基，它们可以未被取代或被一个或多个相同或不同的选自卤素原子和烷氧基的取代基取代、或 R2、R3、R6 和 R7 中各自独立地具有上述含义之一，且 R4 和 R'共同代表一个亚烷基，或 R2、R3、R4 和 R5 中各自独立地具有上述含义之一，且 R6 和 R7 共同代表一个亚烷基；或其酸加成盐。
• Process for conversion of certain trans 3,4-methano-pyrrolidine derivatives into their corresponding cis isomers, a novel unsaturated intermediate in the process and derivatives thereof, a process for preparing the novel intermediate and derivatives thereof, pollen-suppressing compositions and a method of producing F1hybrid seed
  申请人：SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V.

  公开号：EP0031176A2

  公开（公告）日：1981-07-01

  A process for the conversion of the transisomer of an acid whose carbon skeleton includes the unit or a salt, ester, or salt of an ester thereof, into the cis isomer of such a compound which comprises converting the trans isomer into an acid whose carbon skeleton includes the unit or a salt thereof, and subsequently hydrogenating said compound and, in the event of an ester or salt thereof being required converting the resulting free acid or salt thereof into the required ester or salt thereof. The compound 2-carboxy-3-aza-bicyclo 3.1.0 hex-2-ene or a salt and/or amide, alkylamide, hydrazide or alkylhydrazide thereof may be used as a pollen suppressant.

  一种碳骨架包括以下单元的酸的反式体的转化工艺 或其盐、酯或酯的盐，转化为该化合物的顺式异构体的工艺，包括将反式异构体转化为碳骨架包含该单元的酸 或其盐，然后将所述化合物氢化，如果需要酯或其盐，则将所得游离酸或其盐转化为所需的酯或其盐。化合物 2-羧基-3-氮杂双环 3.1.0-己-2-烯或其盐和/或酰胺、烷基酰胺、酰肼或烷基酰肼可用作花粉抑制剂。
• Tricyclic quinoline and quinoxaline derivatives
  申请人：AbbVie Deutschland GmbH & Co. KG

  公开号：US10118926B2

  公开（公告）日：2018-11-06

  The present invention relates to tricyclic quinoline and quinoxaline derivatives, to a pharmaceutical composition containing such compounds, to their use as modulators, especially agonists or partial agonists, of the 5-HT2C receptor, their use for preparing a medicament for the prevention or treatment of conditions and disorders which respond to the modulation of 5-HT2C receptor, and to a method for preventing or treating conditions and disorders which respond to the modulation of 5-HT2C receptor.

  本发明涉及三环喹啉和喹喔啉衍生物，涉及含有此类化合物的药物组合物，涉及它们作为 5-HT2C 受体调节剂（尤其是激动剂或部分激动剂）的用途，涉及它们用于制备预防或治疗对 5-HT2C 受体调节有反应的病症和紊乱的药物，还涉及一种预防或治疗对 5-HT2C 受体调节有反应的病症和紊乱的方法。