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3-甲基-4-哌啶酮 | 5773-58-0

中文名称
3-甲基-4-哌啶酮
中文别名
3-甲基-4-哌啶
英文名称
3-methylpiperidin-4-one
英文别名
3-Methyl-piperidon-(4)
3-甲基-4-哌啶酮化学式
CAS
5773-58-0
化学式
C6H11NO
mdl
——
分子量
113.159
InChiKey
KTWRIXHINMYODR-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    -0.2
  • 重原子数:
    8
  • 可旋转键数:
    0
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.83
  • 拓扑面积:
    29.1
  • 氢给体数:
    1
  • 氢受体数:
    2

反应信息

  • 作为反应物:
    描述:
    3-甲基-4-哌啶酮盐酸 、 3 A molecular sieve 、 sodium cyanoborohydride 、 sodium carbonate 、 sodium iodide 作用下, 以 甲醇乙腈 为溶剂, 反应 192.0h, 生成 1-<2-(4-ethyl-4,5-dihydro-5-oxo-1H-tetrazol-1-yl)ethyl>-3-methyl-4-(4-bromo-2-fluoroanilino)piperidine
    参考文献:
    名称:
    The synthesis of [fluorophenyl-3H(N)] ocfentanil and [fluorophenyl-3H(N)] brifentanil
    摘要:
    [氟苯基-3H(N)] 奥芬太尼(1b)和[氟苯基-3H(N)] 布芬太尼[2b]是通过催化三反应适当的溴前体(1a、2a)合成的。产物经制备型高效液相色谱纯化,并通过色谱和质子解耦 3H NMR 进行表征。
    DOI:
    10.1002/jlcr.2580361102
  • 作为产物:
    参考文献:
    名称:
    Fuel economy and life-cycle cost analysis of a fuel cell hybrid vehicle
    摘要:
    The most promising vehicle engine that can overcome the problem of present internal combustion is the hydrogen fuel cell. Fuel cells are devices that change chemical energy directly into electrical energy without combustion. Pure fuel cell vehicles and fuel cell hybrid vehicles (i.e. a combination of fuel cell and battery) as energy sources are studied. Considerations of efficiency, fuel economy, and the characteristics of power output in hybridization of fuel cell vehicle are necessary, In the case of Federal Urban Driving Schedule (FUDS) cycle simulation, hybridization is more efficient than a pure fuel cell vehicle. The reason is that it is possible to capture regenerative braking energy and to operate the fuel cell system within a more efficient range by using battery.Life-cycle cost is largely affected by the fuel cell size, fuel cell cost, and hydrogen cost. When the cost of fuel cell is high, hybridization is profitable, but when the cost of fuel cell is less than 400 US$/kW. a pure fuel cell vehicle is more profitable. (C) 2002 Elsevier Science B.V. All rights reserved.
    DOI:
    10.1016/s0378-7753(01)00965-x
  • 作为试剂:
    描述:
    potassium tert-butylate甲氧基甲基三苯基氯化膦 、 1-(4-chlorocinnamyl)-3-methylpiperidin-4-one 、 3-甲基-4-哌啶酮4-Chlor-cinnamylchlorid3-甲基-4-哌啶酮乙醚Sodium sulfate-III 、 silica gel 、 cyclohexane, ethyl acetate 作用下, 以 四氢呋喃 为溶剂, 反应 1.5h, 以to afford 1-(4-chlorocinnamyl)-4-[1-methoxy-methylidene]-3-methyl-piperidine的产率得到1-(4-chlorocinnamyl)-4-(1-methoxy-methylidene)-3-methylpiperidine
    参考文献:
    名称:
    SPIROINDOLINE DERIVATIVES HAVING INSECTICIDAL PROPERTIES
    摘要:
    式(I)的杀虫化合物,其中Y是单键,C═O,C═S或S(O)m,其中m为0,1或2;R1、R2、R3、R4、R8A1、A2、A3、A4、B1、B2、B3和B4是特定的有机基团或其盐或N-氧化物;含有它们的组合物以及它们在控制昆虫、螨、线虫或软体动物方面的应用。
    公开号:
    US20090042921A1
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文献信息

  • [EN] NOVEL TRICYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM<br/>[FR] NOUVEAUX COMPOSES TRICYCLIQUES UTILES POUR TRAITER LES TROUBLES INFLAMMATOIRES ET ALLERGIQUES, PROCEDE DE PREPARATION DE CES COMPOSES ET COMPOSITIONS PHARMACEUTIQUES LES CONTENANT
    申请人:GLENMARK PHARMACEUTICALS LTD
    公开号:WO2004037805A1
    公开(公告)日:2004-05-06
    The present invention relates to novel tricyclic compounds useful for the treatment of inflammatory conditions, diseases of the central nervous and insulin resistant diabetes.
    本发明涉及用于治疗炎症性疾病、中枢神经系统疾病和胰岛素抵抗性糖尿病的新型三环化合物
  • [EN] TETRAHYDRONAPHTHALENE DERIVATIVES USEFUL AS NRF2 ACTIVATORS<br/>[FR] DÉRIVÉS DE TÉTRAHYDRONAPHTALÈNE UTILES EN TANT QU'ACTIVATEURS DE NRF2
    申请人:BIOGEN MA INC
    公开号:WO2019104030A1
    公开(公告)日:2019-05-31
    Provided are compounds of Formula I, or pharmaceutically acceptable salts thereof, and methods for their use as Nrf2 activators and for their production.
    提供的是I式化合物,或其药用可接受的盐,以及它们作为Nrf2激活剂的使用方法和生产方法。
  • [EN] ANALGESIC THAT BINDS FILAMIN A<br/>[FR] ANALGÉSIQUE QUI SE LIE À LA FILAMINE A
    申请人:PAIN THERAPEUTICS INC
    公开号:WO2010051374A1
    公开(公告)日:2010-05-06
    A compound, composition and method are disclosed that can provide analgesia. A contemplated compound has a structure that corresponds to Formula A, wherein A, B, X, R1, R2, R7 and R8, and the dashed lines are defined within.
    公开了一种化合物、组合物及方法,能够提供镇痛效果。所考虑的化合物具有与式A相对应的结构,其中A、B、X、R1、R2、R7和R8以及虚线均在定义范围内。
  • [EN] 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY<br/>[FR] HÉTÉROARYLAMINOSULFONAMIDES À 5 CHAÎNONS POUR LE TRAITEMENT D'ÉTATS À MÉDIATION PAR UNE ACTIVITÉ CFTR DÉFICIENTE
    申请人:GENZYME CORP
    公开号:WO2021097057A1
    公开(公告)日:2021-05-20
    The invention relates to heteroaryl compounds, pharmaceutically acceptable salts thereof, and pharmaceutical preparations thereof. Also described herein are compositions and the use of such compounds in methods of treating diseases and conditions mediated by deficient CFTR activity, in particular cystic fibrosis.
    这项发明涉及杂环芳基化合物,其药用盐以及药物制剂。本文还描述了这些化合物的组成以及在治疗由CFTR活性不足介导的疾病和病况的方法中的使用,特别是囊性纤维化。
  • CYCLIC AMIDE DERIVATIVES AS INHIBITORS OF 11 - BETA - HYDROXYSTEROID DEHYDROGENASE AND USES THEREOF
    申请人:CONNEXIOS LIFE SCIENCES PVT. LTD.
    公开号:US20150158860A1
    公开(公告)日:2015-06-11
    The present invention relates to certain amide derivatives that have the ability to inhibit 11-β-hydroxysteroid dehydrogenase type 1 (11β-HSD-1) and which are therefore useful in the treatment of certain disorders that can be prevented or treated by inhibition of this enzyme. In addition the invention relates to the compounds, methods for their preparation, pharmaceutical compositions containing the compounds and the uses of these compounds in the treatment of certain disorders. It is expected that the compounds of the invention will find application in the treatment of conditions such as non-insulin dependent type 2 diabetes mellitus (NIDDM), insulin resistance, obesity, impaired fasting glucose, impaired glucose tolerance, lipid disorders such as dyslipidemia, hypertension and as well as other diseases and conditions.
    本发明涉及某些酰胺衍生物,这些衍生物具有抑制11-β-羟基类固醇脱氢酶1型(11β-HSD-1)的能力,因此在预防和治疗可以通过抑制该酶来预防或治疗的某些疾病中是有用的。此外,发明还涉及这些化合物的制备方法、含有这些化合物的药物组合物以及这些化合物在治疗某些疾病中的用途。预计本发明的化合物将在治疗非胰岛素依赖型2型糖尿病(NIDDM)、胰岛素抵抗、肥胖、空腹血糖受损、葡萄糖耐量受损、脂质紊乱(如血脂异常)、高血压以及其他疾病和状况中找到应用。
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