N-乙基环庚烷胺 | 45806-60-8

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: N-乙基环庚烷胺
• 中文别名: N-环庚基-n-乙胺
• 英文名称: N-ethylcycloheptanamine
• 英文别名: N-ethylcycloheptylamine
• CAS: 45806-60-8
• 化学式: C₉H₁₉N
• mdl: MFCD08691721
• 分子量: 141.257
• InChiKey: VFPQRGMSTSEZFW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  10
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  12
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 危险等级：
  IRRITANT
• 危险品标志：
  Xi
• 海关编码：
  2921300090

反应信息

• 作为反应物：
  描述：

  2,4-二溴-6-溴甲基苯酚 、 N-乙基环庚烷胺 以 乙醇 为溶剂， 生成 2,4-Dibromo-6-[[cycloheptyl(ethyl)amino]methyl]phenol
  参考文献：
  名称：

  CH597148

  摘要：

  公开号：
• 作为产物：
  描述：

  N-Cycloheptyl-acetamid 在 二乙基硅烷 作用下， 以 苯 为溶剂， 以72%的产率得到N-乙基环庚烷胺
  参考文献：
  名称：

  二乙基硅烷作为金纳米颗粒催化还原反应中的有力试剂

  摘要：

  相对于典型的氢硅烷，二乙基硅烷在由Au纳米颗粒催化的羰基化合物，亚胺和酰胺的还原中表现出显着的反应性。

  DOI：

  10.1002/ejoc.202000483

文献信息

• 8-Phenyl-6, 9-dihydro-[1,2,4] triazolo[3,4-i]purin-5-one derivatives
  申请人：——

  公开号：US20030060627A1

  公开（公告）日：2003-03-27

  8-phenyl-6,9-dihydro-[1,2,4]triazolo[3,4-i]purin-5-one derivatives of formula (I): 1 wherein: R 1 , R 2 and R 3 each independently represent: hydrogen; an alkyl group which is unsubstituted or substituted by a hydroxy, alkoxy, alkylthio, amino, mono- or di-alkylamino, hydroxycarbonyl, alkoxycarbonyl, acylamino, carbamoyl or alkylcarbamoyl group; or a group of formula —(CH 2 ) n —R 6 wherein n is an integer from 0 to 4 and R 6 represents: a cycloalkyl group; a phenyl group which may be unsubstituted or substituted by one or more halogen atoms or alkyl, hydroxy, alkylenedioxy, alkoxy, amino, mono- or di-alkylamino, nitro, cyano or trifluoromethyl groups; or a 3 to 7-membered ring comprising from 1 to 4 heteroatoms selected from nitrogen, oxygen and sulphur, which ring may be unsubstituted or substituted by one or more halogen atoms or hydroxy, phenyl, alkoxycarbonyl, amino, mono- alkylamino, di-alkylamino or hydroxycarbonyl groups or one or more alkyl groups which may in turn be unsubstituted or substituted by one or more halogen atoms or hydroxy, alkoxy, hydroxyalkoxy, phenyl, alkoxycarbonyl, amino, mono- or di-alkylamino or hydroxycarbonyl groups; either R 4 and R 5 together with the nitrogen atom to which they are attached form a 3 to 7-membered ring comprising a total of from 1 to 4 heteroatoms selected from nitrogen, oxygen and sulphur, which ring may be unsubstituted or substituted by one or more halogen atoms or hydroxy, oxoalkyl, carbamoyl, hydroxycarbonyl, alkoxycarbonyl, trifluoroacetyl, amino, mono- or di-alkylamino groups or an alkylene group, or one or more alkyl, alkenyl or alkynyl groups which may in turn be unsubstituted or substituted by one or more halogen atoms or hydroxy, alkoxy, hydroxyalkoxy, amino or mono- or di-alkylamino groups, or R 4 and R 5 independently represent hydrogen, an amidino group or an alkyl, alkenyl or alkynyl group which may be unsubstituted or substituted by one or more halogen atoms or hydroxy, alkoxy, alkylthio, amino, mono- or di-alkylamino groups, or R 4 represents hydrogen or an alkyl group and R 5 represents a group of formula —(CH 2 ) n —R 7 wherein n is an integer from 0 to 4 and R 7 represents: a cycloalkyl group which may be unsubstituted or substituted by one or more halogen atoms or alkyl, hydroxy, alkylenedioxy, alkoxy, amino, mono- or di-alkylamino, alkylamido, nitro, cyano or trifluoromethyl groups; a phenyl group which may be unsubstituted or substituted by one or more halogen atoms or alkyl, hydroxy, alkylenedioxy, alkoxy, amino, mono- or di-alkylamino, nitro, cyano or trifluoromethyl groups; or a 3 to 7-membered ring comprising from 1 to 4 heteroatoms selected from nitrogen, oxygen and sulphur, which ring may be unsubstituted or substituted by one or more halogen atoms or hydroxy, alkoxy, phenyl, alkoxycarbonyl, amino, mono-alkylamino, di-alkylamino or hydroxycarbonyl groups or one or more alkyl groups which may be unsubstituted or substituted by one or more halogen atoms or hydroxy, alkoxy, hydroxyalkoxy, phenyl, alkoxycarbonyl, amino, mono- or di-alkylamino or hydroxycarbonyl groups; or a pharmaceutically acceptable salt thereof; processes for their preparation, pharmaceutical compositions containing them and their use as PDE 5 inhibitors.

  8-苯基-6,9-二氢-[1,2,4]三唑[3,4-i]嘧啶-5-酮衍生物的化学式（I）如下： 其中： R1、R2和R3各自独立表示：氢；未取代或取代的烷基基团，取代基可以是羟基、烷氧基、烷基硫基、氨基、单烷基或双烷基氨基、羟基羰基、烷氧羰基、酰胺基、氨基甲酰基或烷基甲酰基基团；或者化学式—(CH2)n—R6的基团，其中n是从0到4的整数，R6表示：环烷基基团；苯基基团，可以未取代或取代，取代基可以是一个或多个卤素原子或烷基、羟基、烷基二氧基、烷氧基、氨基、单烷基或双烷基氨基、硝基、氰基或三氟甲基基团；或者由1到4个异原子（氮、氧和硫）组成的3到7元环，该环可以未取代或取代，取代基可以是一个或多个卤素原子或羟基、苯基、烷氧羰基、氨基、单烷基氨基、双烷基氨基或羟基羰基基团或一个或多个烷基基团，该烷基基团可以未取代或取代，取代基可以是一个或多个卤素原子或羟基、烷氧基、羟基烷氧基、苯基、烷氧羰基、氨基、单烷基或双烷基氨基或羟基羰基基团； R4和R5可以与它们连接的氮原子一起形成一个由1到4个异原子（氮、氧和硫）组成的3到7元环，该环可以未取代或取代，取代基可以是一个或多个卤素原子或羟基、氧代烷基、氨基甲酰基、羟基羰基、烷氧羰基、三氟乙酰基、氨基、单烷基或双烷基氨基基团或一个烷基、烯基或炔基基团，该基团可以未取代或取代，取代基可以是一个或多个卤素原子或羟基、烷氧基、羟基烷氧基、氨基或单烷基或双烷基氨基基团，或者R4和R5各自独立表示氢、酰胺基团或未取代或取代的烷基、烯基或炔基基团，取代基可以是一个或多个卤素原子或羟基、烷氧基、烷基硫基、氨基、单烷基或双烷基氨基基团，或者R4表示氢或烷基基团，R5表示化学式—(CH2)n—R7的基团，其中n是从0到4的整数，R7表示：环烷基基团，可以未取代或取代，取代基可以是一个或多个卤素原子或烷基、羟基、烷基二氧基、烷氧基、氨基、单烷基或双烷基氨基、烷基酰胺基、硝基、氰基或三氟甲基基团；苯基基团，可以未取代或取代，取代基可以是一个或多个卤素原子或烷基、羟基、烷基二氧基、烷氧基、氨基、单烷基或双烷基氨基、硝基、氰基或三氟甲基基团；或者由1到4个异原子（氮、氧和硫）组成的3到7元环，该环可以未取代或取代，取代基可以是一个或多个卤素原子或羟基、烷氧基、苯基、烷氧羰基、氨基、单烷基氨基、双烷基氨基或羟基羰基基团或一个或多个烷基基团，该烷基基团可以未取代或取代，取代基可以是一个或多个卤素原子或羟基、烷氧基、羟基烷氧基、苯基、烷氧羰基、氨基、单烷基或双烷基氨基或羟基羰基基团； 或其药学上可接受的盐；它们的制备方法、含有它们的药物组合物以及它们作为PDE 5抑制剂的用途。
• Pyrrolotriazolopyrimidinone derivatives
  申请人：——

  公开号：US20040019034A1

  公开（公告）日：2004-01-29

  This invention relates to new therapeutically useful 8-(disubstituted)phenyl-6,9-dihydro-5H-pyrrolo[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-5-one and 8-phenyl-6,9-dihydro-5H-pyrrolo[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-5-one derivatives of formula (I): wherein: —X—C—Y— represents (a) or (b) to processes and intermediates for their preparation, to pharmaceutical compositions containing them and to their medical uses as potent and selective inhibitors of phosphodiesterase 5 (PDE 5).

  这项发明涉及新的治疗用途的8-(二取代)苯基-6,9-二氢-5H-吡咯[2,3-e][1,2,4]三唑[4,3-c]嘧啶-5-酮和8-苯基-6,9-二氢-5H-吡咯[3,2-e][1,2,4]三唑[4,3-c]嘧啶-5-酮衍生物的公式(I)：其中：—X—C—Y—代表(a)或(b)到它们的制备过程和中间体，含有它们的药物组合物以及它们作为磷酸二酯酶5 (PDE 5)的有效和选择性抑制剂的医学用途。
• BIARYL AMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF
  申请人：Katayama Seiji

  公开号：US20130116227A1

  公开（公告）日：2013-05-09

  Disclosed is a novel biaryl amide derivative represented by formula (1) and having an affinity for the aldosterone receptor; also disclosed is a pharmaceutically acceptable salt thereof. (In the formula, A is any of the groups represented by formula (a); L is —CONH—, etc.; R 1 is a substitutable aminosulfonyl group, etc.; R 2 is a hydrogen atom, etc.; R 3 is a hydrogen atom, etc.; R 4 is a hydrogen atom, a halogen atom, hydroxy group, a substitutable amino group, a substitutable C 1-6 alkoxy group, a substitutable 4- to 7-membered cyclic amino group, etc.; R 5a , R 5b and R 5c are each independently hydrogen atoms, etc.; R 6 is a halogen atom, a cyano group, etc.; R 7 and R 8 are each independently a hydrogen atom, etc.; and m is an integer such as 0.)

  揭示了一种表示为公式（1）的新型联苯酰胺衍生物，具有与醛固酮受体的亲和力；还揭示了其药用可接受的盐。（在该公式中，A是由公式（a）表示的任何基团之一；L是—CONH—等；R1是可替代的氨基磺酰基等；R2是氢原子等；R3是氢原子等；R4是氢原子、卤原子、羟基、可替代的氨基基团、可替代的C1-6烷氧基、可替代的4-到7-成员环氨基基团等；R5a、R5b和R5c各自独立地是氢原子等；R6是卤原子、氰基等；R7和R8各自独立地是氢原子等；m是整数，例如0。）
• Pyrrolo[2,3-d]pyrimidine compounds
  申请人：——

  公开号：US20020019526A1

  公开（公告）日：2002-02-14

  A compound of the formula 1 wherein R 1 , R 2 and R 3 are as defined above, which are inhibitors of the enzyme protein tyrosine kinases such as Janus Kinase 3 and as such are useful therapy as immunosuppressive agents for organ transplants, lupus, multiple sclerosis, rheumatoid arthritis, psoriasis, Type I diabetes and complications from diabetes, cancer, asthma, atopic dermatitis, autoimmune thyroid disorders, ulcerative colitis, Crohn's disease, Alzheimer's disease, Leukemia and other autoimmune diseases.

  一种化合物的结构式，其中R1、R2和R3如上所定义，它们是蛋白酪氨酸激酶的抑制剂，如Janus激酶3，因此可作为免疫抑制剂用于器官移植、狼疮、多发性硬化、类风湿性关节炎、牛皮癣、1型糖尿病和糖尿病并发症、癌症、哮喘、特应性皮炎、自身免疫性甲状腺疾病、溃疡性结肠炎、克罗恩病、阿尔茨海默病、白血病和其他自身免疫疾病的治疗。
• Studies on 2-oxoquinoline derivatives as blood platelet aggregation inhibitors. III. N-Cyclohexyl-N-(2-hydroxyethyl)-4-(1,2-dihydro-2-oxo-6-quinolyloxy)butyramide and related compounds.
  作者：TAKAO NISHI、FUJIO TABUSA、TATSUYOSHI TANAKA、HIRAKI UEDA、TAKEFUMI SHIMIZU、TOSHIMI KANBE、YUKIO KIMURA、KAZUYUKI NAKAGAWA

  DOI：10.1248/cpb.31.852

  日期：——

  A series of N, N-disubstituted-ω-(1, 2-dihydro-2-oxoquinolyloxy) alkanecarboxamides was synthesized and tested for inhibitory activity towards collagen- and ADP-induced aggregation of rabbit blood platelet in vitro. These compounds were prepared by the reaction of ω-(1, 2-dihydro-2-oxoquinolyloxy) alkanoic acid and various amines by the mixed anhydride method. Among them, N-cyclohexyl-N-(2-hydroxyethyl)-4-(1, 2-dihydro-2-oxo-6-quinolyloxy) butyramide (IVa1) was found to have the most potent inhibitory activity. The structure-activity relationships are discussed.

  合成了一系列 N,N-取代的ω-(1, 2-二氢-2-氧羟喹啉氧基)烷基氨基酸酰胺，并对其在体外对胶原和ADP诱导的兔血小板聚集的抑制活性进行了测试。这些化合物是通过ω-(1, 2-二氢-2-氧羟喹啉氧基)烷酸与各种胺反应，采用混合酸酐法制备的。其中，N-环己基-N-(2-羟乙基)-4-(1, 2-二氢-2-氧-6-喹啉氧基)丁酰胺（IVa1）被发现具有最强的抑制活性。文中讨论了结构-活性关系。