1-(3-氯吡啶-2-基)哌啶-4-酮 | 801306-58-1

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 1-(3-氯吡啶-2-基)哌啶-4-酮
• 英文名称: 1-(3-chloropyridin-2-yl)piperidin-4-one
• CAS: 801306-58-1
• 化学式: C₁₀H₁₁ClN₂O
• 分子量: 210.663
• InChiKey: KLPGLRMIGFTYRT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  33.2
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-(3-氯吡啶-2-基)哌啶-4-酮 在 盐酸 、 水 、 三氯氧磷 作用下， 以 吡啶 、 水 为溶剂， 反应 46.0h， 生成 1-(3-chloropyridin-2-yl)piperidine-4-carboxylic acid
  参考文献：
  名称：

  WO2005/4866

  摘要：

  公开号：
• 作为产物：
  描述：

  2,3-二氯吡啶 在 草酰氯 、 二甲基亚砜 、 三乙胺 作用下， 以 二氯甲烷 、 二甲基亚砜 为溶剂， 生成 1-(3-氯吡啶-2-基)哌啶-4-酮
  参考文献：
  名称：

  Compounds as TRVP1 Blockers, Pharmaceutical Compositions and Medical Uses Thereof

  摘要：

  披露了一种新化合物及其药用盐和水合物。还提供了这些药物组合物。还提供了这些化合物、药用盐、水合物和药物组合物用于治疗TRPV1介导疾病的医疗用途。

  公开号：

  US20120184509A1

文献信息

• Therapeutic agents useful for treating pain
  申请人：Kyle J. Donald

  公开号：US20070027159A1

  公开（公告）日：2007-02-01

  A compound of formula: wherein Ar 1 , Ar 2 , V, X, R 3 , R 4 , and m are as disclosed herein or a pharmaceutically acceptable salt thereof (a “Cyclo(hetero)alkenyl Compound”); compositions comprising an effective amount of a Cyclo(hetero)alkenyl Compound; and methods for treating or preventing, e.g., pain, UI, an ulcer, IBD, or IBS in an animal, comprising administering to an animal in need thereof an effective amount of a Cyclo(hetero)alkenyl Compound are disclosed herein.

  本文披露了一种化合物，其分子式为：其中Ar1、Ar2、V、X、R3、R4和m如本文所述或其药学上可接受的盐（“环（杂）烯基化合物”）；包含有效量的环（杂）烯基化合物的组合物；以及治疗或预防动物的疼痛、尿失禁、溃疡、炎症性肠病或肠易激综合征等疾病的方法，包括向需要的动物中投与有效量的环（杂）烯基化合物。
• THERAPEUTIC AGENTS USEFUL FOR TREATING PAIN
  申请人：Kyle Donald J.

  公开号：US20110152324A1

  公开（公告）日：2011-06-23

  A compound of formula: wherein Ar 1 , Ar 2 , V, X, R 3 , R 4 , and m are as disclosed herein or a pharmaceutically acceptable salt thereof (a “Cyclo(hetero)alkenyl Compound”); compositions comprising an effective amount of a Cyclo(hetero)alkenyl Compound; and methods for treating or preventing, e.g., pain, UI, an ulcer, IBD, or IBS in an animal, comprising administering to an animal in need thereof an effective amount of a Cyclo(hetero)alkenyl Compound are disclosed herein.

  本文披露了一种化合物，其化学式为：其中Ar1，Ar2，V，X，R3，R4和m如本文所述，或其药物可接受的盐（“环（杂）烯基化合物”）；包含有效量的环（杂）烯基化合物的组合物；以及治疗或预防动物的疼痛、尿失禁、溃疡、炎症性肠病或肠易激综合征等疾病的方法，包括向需要治疗的动物投与有效量的环（杂）烯基化合物。
• Therapeutic Agents Useful for Treating Pain
  申请人：Kyle Donald J.

  公开号：US20130012541A1

  公开（公告）日：2013-01-10

  A compound of formula: wherein Ar 1 , Ar 2 , V, X, R 3 , R 4 , and m are as disclosed herein or a pharmaceutically acceptable salt thereof (a “Cyclo(hetero)alkenyl Compound”); compositions comprising an effective amount of a Cyclo(hetero)alkenyl Compound; and methods for treating or preventing, e.g., pain, UI, an ulcer, IBD, or IBS in an animal, comprising administering to an animal in need thereof an effective amount of a Cyclo(hetero)alkenyl Compound are disclosed herein.

  本文介绍了一种化合物，其化学式为：其中Ar1，Ar2，V，X，R3，R4和m如本文所述或其药学上可接受的盐（“环（杂）烯基化合物”）; 包含有效量的环（杂）烯基化合物的组合物; 以及治疗或预防动物的疼痛，UI，溃疡，IBD或IBS的方法，包括向需要的动物施用有效量的环（杂）烯基化合物。
• Compounds as TRPV1 antagonists, pharmaceutical compositions and medical uses thereof
  申请人：Sun Qun

  公开号：US08748610B2

  公开（公告）日：2014-06-10

  A kind of new compounds, and their pharmaceutically acceptable salts, and hydrates are disclosed. The pharmaceutical composition thereof is also provided. And also are the medical uses of the compounds, pharmaceutically acceptable salts, hydrates and the pharmaceutical composition for treating the TRPV1-mediate diseases.

  本发明公开了一种新的化合物及其药用可接受盐和水合物。同时，提供了该药物组合物的制备方法。此外，还公开了该化合物、药用可接受盐和水合物以及药物组合物在治疗TRPV1介导的疾病方面的医疗用途。
• Tetrahydropyridine-4-carboxamides as novel, potent transient receptor potential vanilloid 1 (TRPV1) antagonists
  作者：Brian S. Brown、Ryan Keddy、Guo Zhu Zheng、Robert G. Schmidt、John R. Koenig、Heath A. McDonald、Bruce R. Bianchi、Prisca Honore、Michael F. Jarvis、Carol S. Surowy、James S. Polakowski、Kennan C. Marsh、Connie R. Faltynek、Chih-Hung Lee

  DOI：10.1016/j.bmc.2008.08.005

  日期：2008.9

  A series of 1,2,3,6-tetrahydropyridyl-4-carboxamides, exemplified by 6, have been synthesized and evaluated for in vitro TRPV1 antagonist activity, and in vivo analgesic activity in animal pain models. The tetrahydropyridine 6 is a novel TRPV1 receptor antagonist that potently inhibits receptor-mediated Ca2+ influx in vitro induced by several agonists, including capsaicin, N-arachidonoyldopamine (NADA), and low pH. This compound penetrates the CNS and shows potent anti-nociceptive effects in a broad range of animal pain models upon oral dosing due in part to its ability to antagonize both central and peripheral TRPV1 receptors. The SAR leading to the discovery of 6 is presented in this report. (C) 2008 Elsevier Ltd. All rights reserved.