N,N-dimethyl-1-indanylamine | 91245-71-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 茚满类
• 英文名称: N,N-dimethyl-1-indanylamine
• 英文别名: indan-1-yl-dimethyl-amine；Dimethyl-α-hydrindyl-amin；1-Dimethylamino-hydrinden；Indan-1-yl-dimethyl-amin；(+/-)-N,N-Dimethyl-1-indanamin；N.N-Dimethyl-1-indanamin；2,3-Dihydro-N,N-dimethyl-1H-inden-1-amine；N,N-dimethyl-2,3-dihydro-1H-inden-1-amine
• CAS: 91245-71-5
• 化学式: C₁₁H₁₅N
• 分子量: 161.247
• InChiKey: AYHQTEFLQACZEI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  12
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  3.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  N,N-dimethyl-1-indanylamine 在 正丁基锂 、 四丁基氟化铵 作用下， 以 乙醚 、 正己烷 、 乙腈 为溶剂， 反应 26.0h， 生成 exo-2-cyano-4,5-benzobicyclo[2.2.1]heptane
  参考文献：
  名称：

  Reactivity and endo–exo Selectivity in Diels–Alder Reaction of o-Quinodimethanes. An Experimental and DFT Computational Study

  摘要：

  endo-exo Selectivity in Diels-Alder cycloadditions of several o-quinodimethanes (1-4) with acrylonitrile, 2-(5H)-furanone and N-methylmaleimide has been investigated in acetonitrile solution. Transition structures of the cycloaddition of the parent o-QDM (1), (E,E)1,8-dimethyl-o-QDM (2), isoindene (3) and 2,3-dihydronaphthalene (4) with acrylonitrile and maleimide were located at both HF/6-31G* and B3LYP/6-31G* methods. Theoretical data reproduce fairly well both experimental absolute reaction rates and diastereoisomer ratios. The high endo selectivity has been rationalized mainly as a result of solvation effects (acetonitrile, PCM model) and reactant deformations. The latter is due to steric interactions. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(00)00126-5
• 作为产物：
  描述：

  聚合甲醛 、 1-氨基茚满 在 甲酸 作用下， 生成 N,N-dimethyl-1-indanylamine
  参考文献：
  名称：

  Conformational Mobility and Optical Rotation Effects of Aromatic Nuclei¹

  摘要：

  DOI：

  10.1021/ja00962a028

文献信息

• COMPOSITIONS CONTAINING AND METHODS OF USING 1-AMINOINDAN AND DERIVATIVES THEREOF AND PROCESS FOR PREPARING OPTICALLY ACTIVE 1-AMINOINDAN DERIVATIVES
  申请人：——

  公开号：US20020068839A1

  公开（公告）日：2002-06-06

  Novel derivatives of 1-aminoindan and their salts are described. Optically active 1-aminoindan derivatives are prepared by reacting a N-benzyl analog of the desired compound with an enantiomer of mandelic acid. Parkinson's disease, dementia, epilepsy, convulsions, or seizures are treated by administering a compound of the formula: 1

  描述了1-氨基茚的新衍生物及其盐。通过将所需化合物的N-苯甲基类似物与苯丙酸对映异构体反应制备了光学活性的1-氨基茚衍生物。通过给予公式1的化合物治疗帕金森病、痴呆症、癫痫、惊厥或抽搐。
• INDANE-AMINE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICAMENTS
  申请人：Garcia-Lopez Monica

  公开号：US20120264799A1

  公开（公告）日：2012-10-18

  The present invention relates to indane-amine derivatives, to processes for the preparation thereof, to medicaments comprising them as well as to their use for the preparation of a medicament for the treatment of 5HT7 receptor mediated diseases or conditions.

  本发明涉及吲哚胺衍生物，其制备过程，包含它们的药物以及它们用于制备治疗5HT7受体介导的疾病或病状的药物的用途。
• 1-AMINOINDAN DERIVATIVES AND COMPOSITIONS THEREOF
  申请人：TEVA PHARMACEUTICAL INDUSTRIES, LTD.

  公开号：EP0738149B1

  公开（公告）日：2006-11-29
• HETEROCYCLES THAT ARE INHIBITORS OF IMPDH ENZYME
  申请人：Bristol-Myers Squibb Co.

  公开号：EP1276739A2

  公开（公告）日：2003-01-22
• US5639913A
  申请人：——

  公开号：US5639913A

  公开（公告）日：1997-06-17