acetone N-aminopiperidine hydrazone | 100033-59-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: acetone N-aminopiperidine hydrazone
• 英文别名: N-(1-methylethylidene)-1-piperidinamine；N-(Piperidin-1-yl)propan-2-imine；N-piperidin-1-ylpropan-2-imine
• CAS: 100033-59-8
• 化学式: C₈H₁₆N₂
• 分子量: 140.228
• InChiKey: MKRIMUGXKATKDI-UHFFFAOYSA-N

物化性质

• 沸点：
  203.7±23.0 °C(Predicted)
• 密度：
  0.95±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  10
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  15.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  acetone N-aminopiperidine hydrazone 在 sodium cyanoborohydride 、 溶剂黄146 作用下， 以 乙腈 为溶剂， 反应 7.25h， 以98%的产率得到1-(isopropylamino)piperidine
  参考文献：
  名称：

  Evidence for Radical Fragmentations from Persistent Singlet Carbenes

  摘要：

  Upon warm up, persistent aminohydrazinocarbenes undergo beta-fragmentation reactions. Experimental as well as computational evidences are reported for the involvement of radical processes. This is the first example of a homolytic fragmentation for a persistent singlet carbene.

  DOI：

  10.1021/ja050028g
• 作为产物：
  描述：

  1-氨基哌啶 以 丙酮 为溶剂， 生成 acetone N-aminopiperidine hydrazone
  参考文献：
  名称：

  Tetrazoline herbicides

  摘要：

  公式I的化合物，以及它们的N-氧化物和农业适用的盐被披露，这些化合物对控制不受欢迎的植被是有用的，其中Q是，Z、Y、R1、R2、R12和t在披露中定义。还披露了含有公式I化合物的组合物，以及一种控制不受欢迎的植被的方法，涉及将植被或其环境与公式I化合物的有效量接触。

  公开号：

  EP0902028A1

文献信息

• 4-(2-AMINO-TETRAHYDRONAPHTHALENYL)PYRIMIDINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER, CONTAINING SAME AS ACTIVE INGREDIENT
  申请人：KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY

  公开号：US20180104242A1

  公开（公告）日：2018-04-19

  The present invention relates to a 4-(2-amino-tetrahydronaphthaleneyl)pyrimidine derivative, a preparation method thereof, and a pharmaceutical composition for the prevention or treatment of cancer comprising the same as an active ingredient. The 4-(2-amino-tetrahydronaphthaleneyl)pyrimidine derivative, the optical isomer thereof, or the pharmaceutically acceptable salt thereof of the present invention is very effective in suppressing anaplastic lymphoma kinase (ALK) activity and as a result it can improve the effectiveness of treatment on cancer cells having anaplastic lymphoma kinase (ALK) fusion proteins such as EML4-ALK and NPM-ALK, so that it can be effectively used as a pharmaceutical composition for preventing or treating cancer.

  本发明涉及一种4-(2-氨基-四氢萘基)嘧啶衍生物，其制备方法以及包含其作为活性成分的用于预防或治疗癌症的药物组合物。本发明的4-(2-氨基-四氢萘基)嘧啶衍生物及其光学异构体或其药用可接受的盐对抑制间变性淋巴瘤激酶（ALK）活性非常有效，从而可以提高对具有间变性淋巴瘤激酶（ALK）融合蛋白如EML4-ALK和NPM-ALK的癌细胞的治疗效果，因此可以有效地作为预防或治疗癌症的药物组合物使用。
• [EN] NOVEL FUSED PYRROLOCARBAZOLES<br/>[FR] NOUVEAUX PYRROLOCARBAZOLES FONDUS
  申请人：CEPHALON INC

  公开号：WO2005063763A1

  公开（公告）日：2005-07-14

  The present invention relates generally to selected fused pyrrolocarbazoles, including pharmaceutical compositions thereof and methods of treating diseases therewith. The present invention is also directed to intermediates and processes for making these fused pyrrolocarbazoles.

  本发明涉及选定的融合吡咯烷基咔唑，包括其医药组合物及用于治疗疾病的方法。本发明还涉及中间体和制备这些融合吡咯烷基咔唑的方法。
• 5-PHENYLPYRIMIDINES, THEIR PREPARATION, COMPOSITIONS COMPRISING THEM AND THEIR USE
  申请人：GYPSER Andreas

  公开号：US20070149551A1

  公开（公告）日：2007-06-28

  5-Phenylpyrimidines of the formula I in which the substituents and the index are as defined below: R 1 ,R 2 are hydrogen, alkyl, haloalkyl, cycloalkyl, halocycloalkyl, alkenyl, haloalkenyl, alkynyl or haloalkynyl, and R 1 and R 2 together with the nitrogen atom to which they are attached may also form a saturated or unsaturated ring which may be interrupted by an ether, thio, sulfoxyl or sulfonyl group and may be substituted by one to four groups R a and/or R b ; R 3 is hydrogen, halogen, cyano, alkyl, haloalkyl, alkoxy, haloalkoxy or alkenyloxy; R 4 is hydrogen, halogen, cyano, hydroxyl, mercapto, azido, alkyl, alkenyl, alkynyl, haloalkyl, alkoxy, alkenyloxy, alkynyloxy, haloalkoxy, alkylthio, alkenylthio, alkynylthio, haloalkylthio, —ON═CRN a R b , —CR c ═NOR a , —NR c N═CR a R b , —NR a R b , —NR c NR a R b , —NOR a , —NR c C (═NR c′ )NR a R b , —NR c C(═O)NR a R b , —NR a C(═O)R c , —NR a C(═NOR c )R c′ , —OC (═O)R c , —C(═NOR c )NR a R b , —CR c (═NNR a R b ), —C (═O)NR a R b or —C(═O) R c ; in which R a , R b and R c are as defined in the description; X is halogen, alkyl, alkoxy or haloalkyl; and m is an integer from 1 to 5; processes for preparing these compounds, compositions comprising them and their use for controlling harmful fungi are described.

  公式I中的5-苯基嘧啶化合物，其中取代基和指数定义如下：R1、R2为氢、烷基、卤代烷基、环烷基、卤代环烷基、烯基、卤代烯基、炔基或卤代炔基，且R1和R2与它们附着的氮原子也可以形成饱和或不饱和环，该环可以被醚、硫、亚硫酰基或磺酰基中断，并且可以被一个到四个基团Ra和/或Rb取代；R3为氢、卤素、氰基、烷基、卤代烷基、烷氧基、卤代烷氧基或烯氧基；R4为氢、卤素、氰基、羟基、巯基、叠氮基、烷基、烯基、炔基、卤代烷基、烷氧基、烯氧基、炔氧基、卤代烷氧基、烷硫基、烯硫基、炔硫基、卤代烷硫基、-ON═CRNaRb，-CRc═NORa，-NRcN═CRaRb，-NRaRb，-NRcNRaRb，-NORa，-NRcC（═NRc'）NRaRb，-NRcC（═O）NRaRb，-NRaC（═O）Rc，-NRaC（═NORc）Rc'，-OC（═O）Rc，-C（═NORc）NRaRb，-CRc（═NNRaRb），-C（═O）NRaRb或-C（═O）Rc；其中Ra、Rb和Rc如描述中所定义；X为卤素、烷基、烷氧基或卤代烷基；m为1至5的整数；描述了制备这些化合物的过程、包含它们的组合物以及它们用于控制有害真菌的用途。
• Pyrimidine derivatives and use thereof as agricultural and horticultural fungicides
  申请人：Ito Mashito

  公开号：US20070167421A1

  公开（公告）日：2007-07-19

  This invention relates to an agrohorticultural fungicide containing benzylpyrimidine derivatives represented by the formula wherein R 1 , R 2 , R 3 , R 4 , R 5 , and R 6 are as defined in the disclosure.

  本发明涉及一种农业园艺用杀菌剂，其包含由以下式表示的苯基嘧啶衍生物：其中R1、R2、R3、R4、R5和R6如说明书所定义。
• Aliphatic Palladation of Ketone N,N-Dimethylhydrazones
  作者：Diego J. Cardenas、Antonio M. Echavarren、Angel Vegas

  DOI：10.1021/om00015a022

  日期：1994.3

  Reaction of hydrazones with Pd(PPh3)2Cl2 and sodium acetate in acetonitrile at 65-75-degrees-C gives rise to carbon-bound palladium enolates resulting from direct aliphatic palladation. The reaction has been carried out with the NN-dimethylhydrazones of 2-propanone, 3-methyl-2-butanone, 1-phenyl-1-ethanone, 1-phenyl-1-propanone, and 3,4-dihydro-1(2H)-naphthalenone and with the N-aminopiperidine hydrazone of 2-propanone. The structure of the palladacycle derived from the NN-dimethylhydrazone of 1-phenyl-1-ethanone PhC(=NNMe2)CH2Pd(PPh3)Cl, has been determined by X-ray diffraction. This complex crystallizes in the monoclinic space group P2(1)/n, with a = 10.1806(3) angstrom, b = 21.716(2) angstrom, c = 9.6678(3) angstrom, beta = 100.10(1)-degrees, Z = 4, and V = 2654.20 angstrom3. The complex trans-[Pd(PPh3)(L)Cl2] (L = 1-phenyl-1-ethanone N,N-dimethylhydrazone) was isolated as an intermediate in the formation of the corresponding palladacycle. The palladacycles resulting from aliphatic activation are remarkably stable compounds, even in the presence of beta-hydrogens cis to the Pd(II) center. However, alkyl halides undergo halide exchange with these palladacycles under mild conditions.