(1R,2S,5R)-2-isopropyl-5-methyl-N-(2-(pyridin-4-yl) ethyl)cyclohexanecarboxamide | 926913-56-6

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: (1R,2S,5R)-2-isopropyl-5-methyl-N-(2-(pyridin-4-yl) ethyl)cyclohexanecarboxamide
• 英文别名: (1R,2S,5R)-5-methyl-2-propan-2-yl-N-(2-pyridin-4-ylethyl)cyclohexane-1-carboxamide
• CAS: 926913-56-6
• 化学式: C₁₈H₂₈N₂O
• 分子量: 288.433
• InChiKey: RJXZNFMRBXSXAS-HYVNUMGLSA-N

物化性质

• 沸点：
  476.0±24.0 °C(Predicted)
• 密度：
  0.997±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  21
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  42
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  4-乙烯基吡啶 、 (1R)-2t-isopropyl-5c-methyl-cyclohexane-r-carboxylic acid amide 在 氢氧化钾 作用下， 以 N-甲基吡咯烷酮 为溶剂， 反应 0.17h， 生成 (1R,2S,5R)-2-isopropyl-5-methyl-N-(2-(pyridin-4-yl) ethyl)cyclohexanecarboxamide
  参考文献：
  名称：

  Amide Addition Reaction

  摘要：

  制备公式II化合物的方法包括将公式RCONH2化合物与公式IIIR化合物反应，其中公式IIIR是具有1至15个碳原子和可选地由氧、氮和硫独立选择的1至5个杂原子的基团，X和Y分别独立选择自H、甲基、乙基、OMe、OEt和它们的混合物组成的群；在溶剂中在碱的存在下进行反应。该方法可用于廉价制造某些具有商业价值的化合物，包括一些具有理想冷却性能的化合物。

  公开号：

  US20090030042A1

文献信息

• Pyridinyl cyclohexanecarboxamide cooling compounds
  申请人：Givaudan, S.A.

  公开号：US10221136B2

  公开（公告）日：2019-03-05

  A method of providing a cooling effect to a product includes the incorporation into the product of at least one compound of the formula I in which m is a number between 0 and 2, X, Y and Z are selected independently from the group consisting of H, halogen, OH, Me, Et, MeO and EtO, and R1, R2 and R3 together comprise at least 6 carbons, selected such that (a) (i) R1 is selected from the group consisting of H, Me, Et, isopropyl and C4-C5 branched alkyl; and  (ii) R2 and R3 are independently selected from the group consisting of Me, Et, isopropyl and Ca-branched alkyl; or (b) any two or all of R1, R2 and R3 together form a monocyclic, bicyclic or tricyclic radical having up to 10 carbons. The compounds confer substantial cooling effects on compositions applied to the skin or taken orally, such as toothpastes, mouthwashes, foodstuffs, beverages, confectionery, tobacco products, skin creams and ointments.

  一种为产品提供冷却效果的方法包括在产品中加入至少一种式 I 的化合物 其中，m 是介于 0 和 2 之间的数字，X、Y 和 Z 独立地选自 H、卤素、OH、Me、Et、MeO 和 EtO 组成的组，R1、R2 和 R3 共包含至少 6 个碳，选取方式为 (a) (i) R1 选自 H、Me、Et、异丙基和 C4-C5 支链烷基组成的组；以及 (ii) R2 和 R3 独立地选自由 Me、Et、异丙基和 C4-C5 支链烷基组成的 组；或 (b) R1、R2 和 R3 中的任意两个或全部共同形成一个单环、双环或三环基团，该基团具有多达 10 个碳原子。 这些化合物可为涂抹在皮肤上或口服的成分，如牙膏、漱口水、食品、饮料、糖果、烟草制品、护肤霜和软膏等，带来显著的降温效果。
• COOLING COMPOUNDS
  申请人：Givaudan SA

  公开号：EP1917074B1

  公开（公告）日：2018-02-28
• AMIDE ADDITION REACTION
  申请人：Givaudan SA

  公开号：EP2178836B1

  公开（公告）日：2013-04-17
• Cooling Compounds
  申请人：Bell Karen Ann

  公开号：US20100035938A1

  公开（公告）日：2010-02-11

  A method of providing a cooling effect to a product includes the incorporation into the product of at least one compound of the formula I in which m is a number between 0 and 2, X, Y and Z are selected independently from the group consisting of H, halogen, OH, Me, Et, MeO and EtO, and R 1 , R 2 and R 3 together comprise at least 6 carbons, selected such that (a) (i) R 1 is selected from the group consisting of H, Me, Et, isopropyl and C 4 -C 5 branched alkyl; and (ii) R 2 and R 3 are independently selected from the group consisting of Me, Et, isopropyl and C 4 -branched alkyl; or (b) any two or all of R 1 , R 2 and R 3 together form a monocyclic, bicyclic or tricyclic radical having up to 10 carbons. The compounds confer substantial cooling effects on compositions applied to the skin or taken orally, such as toothpastes, mouthwashes, foodstuffs, beverages, confectionery, tobacco products, skin creams and ointments.
• Organic Compounds
  申请人：Villagran Francisco Valentino

  公开号：US20120196018A1

  公开（公告）日：2012-08-02

  An orally-administrable product comprising an ingredient or ingredients that have associated with their use an unacceptable aftertaste, and a cooling compound employed as a taste-masking agent in an amount of 0.5 ppm or less.