3-methyl-N-piperidin-1-ylmethyl-butyramide | 57221-23-5

• 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: 3-methyl-N-piperidin-1-ylmethyl-butyramide
• 英文别名: N-piperidinomethyl-isovaleramide；N-Piperidinomethyl-isovaleramid；1,N-(Piperidinomethyl)isovaleramid；3-methyl-N-(piperidin-1-ylmethyl)butanamide
• CAS: 57221-23-5
• 化学式: C₁₁H₂₂N₂O
• 分子量: 198.308
• InChiKey: WYXZSPWZHAYFOC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  14
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.91
• 拓扑面积：
  32.3
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  哌啶 、 聚合甲醛 、 异戊酰胺 生成 3-methyl-N-piperidin-1-ylmethyl-butyramide
  参考文献：
  名称：

  Einhorn; Sproengerts, Justus Liebigs Annalen der Chemie, 1905, vol. 343, p. 270

  摘要：

  DOI：

文献信息

• SINGH G. B.; BINDAL M. C.; DIXIT S. C., J. INDIAN CHEM. SOC <JICS-AH>, 1975, 438-439
  作者：SINGH G. B.、 BINDAL M. C.、 DIXIT S. C.

  DOI：——

  日期：——
• CYANO THIENOTRIAZOLODIAZEPINES AND USES THEREOF
  申请人：Dana-Farber Cancer Institute, Inc.

  公开号：US20200199150A1

  公开（公告）日：2020-06-25

  The present invention provides compounds and pharmaceutically compositions thereof. The compounds and compositions are binders of bromodomains and/or bromodomain-containing proteins (e.g., bromo and extra terminal (BET) proteins). Also provided are methods, uses, and kits using the compounds and pharmaceutical compositions for inhibiting the activity (e.g., increased activity) of bromodomains and/or bromodomain-containing proteins and for treating and/or preventing in a subject diseases associated with bromodomains or bromodomain-containing proteins (e.g., proliferative diseases, cardiovascular diseases, viral infections, fibrotic diseases, metabolic diseases, endocrine diseases, and radiation poisoning). The compounds, pharmaceutical compositions, and kits are also useful for male contraception.
• SMALL MOLECULES FOR INDUCING SELECTIVE PROTEIN DEGRADATION AND USES THEREOF
  申请人：DANA-FARBER CANCER INSTITUTE, INC.

  公开号：US20200407371A1

  公开（公告）日：2020-12-31

  Provided herein are bifunctional compounds that bind a target protein (e.g., a selected protein) and/or induce ubiquitination for degradation of the target protein. In particular, provided are compounds that bind a bromodomain or bromodomain-containing protein (e.g., BET proteins) or histone methyltransferases (HMTs, e.g., enhancer of zeste homolog 1 (EZH1), or FKBP12) and can promote its degradation by recruiting it to the ubiquitin receptor RPN13 (e.g., RA190), for proteasomal degradation. Also provided are pharmaceutical compositions comprising the bifunctional compounds, methods of treating and/or preventing diseases (e.g., proliferative diseases, cancers, benign neoplasms, pathological angiogenesis, inflammatory diseases, and autoimmune diseases) and musculoskeletal diseases, and methods of inducing the degradation of a target (e.g., a target protein) by recruiting it to the ubiquitin receptor RPN13 of the proteasome in a subject by administering a compound or composition described herein.