2,2,2-trifluoro-N-(morpholin-2-ylmethyl)acetamide | 407640-22-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 恶嗪烷类
• 英文名称: 2,2,2-trifluoro-N-(morpholin-2-ylmethyl)acetamide
• CAS: 407640-22-6
• 化学式: C₇H₁₁F₃N₂O₂
• 分子量: 212.172
• InChiKey: WFYCETWFALRRPO-UHFFFAOYSA-N

物化性质

• 沸点：
  292.8±40.0 °C(Predicted)
• 密度：
  1.248±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -0.1
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  50.4
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  2,2,2-trifluoro-N-(morpholin-2-ylmethyl)acetamide 、 3,4-二氯氯苄 在 3,4-二氯氯苄 作用下， 生成 N-{[4-(3,4-dichlorobenzyl)morpholin-2-yl]methyl}-2,2,2-trifluoroacetamide
  参考文献：
  名称：

  Compounds useful in the treatment of inflammatory diseases

  摘要：

  根据本发明提供了一种新的化合物，其化学式为(I)，其中R1、R2、R3、R4、R5、R6、X、a、b和Z的定义如规范中所述，制备它们的方法，包含它们的制剂以及它们在治疗炎症性疾病方面的应用。

  公开号：

  US07157457B2
• 作为产物：
  描述：

  2-(氨甲基)吗啉 生成 2,2,2-trifluoro-N-(morpholin-2-ylmethyl)acetamide
  参考文献：
  名称：

  Compounds useful in the treatment of inflammatory diseases

  摘要：

  根据本发明提供了一种新的化合物，其化学式为(I)，其中R1、R2、R3、R4、R5、R6、X、a、b和Z的定义如规范中所述，制备它们的方法，包含它们的制剂以及它们在治疗炎症性疾病方面的应用。

  公开号：

  US07157457B2

文献信息

• [EN] N-(MORPHOLIN-2YL) METHYL ACETAMIDE DERIVATIVES AS CCR-3 ANTAGONISTS USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES<br/>[FR] DERIVES DE N-(MORPHOLIN-2YL) METHYLE ACETAMIDE SERVANT D'ANTAGONISTES DE CCR-3 ET UTILISES DANS LE TRAITEMENT DE MALADIES INFLAMMATOIRES
  申请人：GLAXO GROUP LTD

  公开号：WO2003082863A1

  公开（公告）日：2003-10-09

  Compounds of formula (I); wherein: R1 represents substituted or unsubstituted heterocyclyl; Y represents -(CRnaRnb)n-; Rna and Rnb are each independently hydrogen or C1-6alkyl; n is an integer from 1 to 5; R2 represents unsubstituted or substituted aryl or unsubstituted or substituted heteroaryl; R3 represents hydrogen or C1-6alkyl; and salts and solvates thereof are CCR-3 antagonists and are thus indicated to be useful in therapy.

  式（I）的化合物；其中：R1代表取代或未取代的杂环烷基；Y代表-(CRnaRnb)n-；Rna和Rnb分别独立地表示氢或C1-6烷基；n是1到5之间的整数；R2代表未取代或取代的芳基或未取代或取代的杂芳基；R3代表氢或C1-6烷基；其盐和溶剂化物是CCR-3拮抗剂，因此被指示在治疗中有用。
• [EN] ANTI-INFLAMMATORY MORPHOLIN-ACETAMIDE DERIVATIVES<br/>[FR] DERIVES DE MORPHOLINE-ACETAMIDE ANTI-INFLAMMATOIRES
  申请人：GLAXO GROUP LTD

  公开号：WO2003082862A1

  公开（公告）日：2003-10-09

  Certain compounds of formula (I): wherein: R1 represents substituted or unsubstituted heteroaryl; Y represents -(CRnaRnb)n-; Rna and Rnb are each independently hydrogen or C1-6alkyl; n is an integer from 1 to 5;R2 represents unsubstituted or substituted aryl or unsubstituted or substituted heteroaryl; R3 represents hydrogen or C1-6alkyl;and salts and solvates thereof are CCR-3 antagonists and are thus indicated to be useful in therapy.

  具有以下化学式（I）的某些化合物：其中：R1代表取代或未取代的杂环烷基；Y代表-(CRnaRnb)n-；Rna和Rnb分别独立地表示氢或C1-6烷基；n为1至5的整数；R2代表未取代或取代的芳基或未取代或取代的杂环烷基；R3代表氢或C1-6烷基；其盐和溶剂合物是CCR-3拮抗剂，因此被认为在治疗中有用。
• Morpholin-acetamide derivatives for the treatment of inflammatory diseases
  申请人：——

  公开号：US20040058923A1

  公开（公告）日：2004-03-25

  Compounds of formula (I) wherein: R 1 represents C 1-16 alkyl, C 2-6 alkenyl, C 2-6 alkynyl, C 2-6 alkynyl-Y 1 —, aryl-Y 1 —, heteroaryl-Y 1 —, aryl-(O) t -aryl-Y 1 —, aryl-(O) t -heteroaryl-Y 1 —, heteroaryl-(O) t -aryl-Y 1 —, heteroaryl-(O) t -heteroaryl-Y 1 —, C 2-6 alkenyl-Y 1 —, aryl-O—Y 1 —, heteroaryl-O—Y 1 —, C 1-16 alkyl-SO 2 —Y 1 —,M—Y 1 —,J 2 -Y 1 —, —CN or C 3-8 cycloalkyl-Y 1 — or C 3-8 cycloalkenyl-Y 1 —, which cycloalkyl or cycloalkenyl may be optionally substituted by one or more hydroxyl or C 1-16 Alkyl groups; R 2 represents hydrogen or C 1-16 alkyl; X represents ethylene or a group of formula CR e R f wherein R e and R f independently represent hydrogen or C 1-14 alkyl or R e and R f may together with the carbon atom to which they are attached form a C 3-8 cycloalkyl group; R 3 and R 4 independently represent hydrogen or C 1-14 alkyl; Z represents a bond, CO, SO 2 , CR 9 R 6 (CH 2 ) n , (CH 2 ) n CR 9 R 6 , CHR 6 (CH 2 ) n O, CHR 6 (CH 2 ) n S, CHR 6 (CH 2 ) n OCO, CHR 6 (CH 2 ) n CO, COCHR 6 (CH 2 ) n or SO 2 CHR 6 (CH 2 ) n ; n represents an integer from 0 to 4; processes for preparing them, formulations containing them and their use in therapy for the treatment of inflammatory diseases. 1

  式(I)的化合物，其中：R1代表C1-16烷基，C2-6烯基，C2-6炔基，C2-6炔基-Y1—，芳基-Y1—，杂环芳基-Y1—，芳基-(O)t-芳基-Y1—，芳基-(O)t-杂环芳基-Y1—，杂环芳基-(O)t-芳基-Y1—，杂环芳基-(O)t-杂环芳基-Y1—，C2-6烯基-Y1—，芳基-O—Y1—，杂环芳基-O—Y1—，C1-16烷基-SO2—Y1—，M—Y1—，J2-Y1—，—CN或C3-8环烷基-Y1—或C3-8环烯基-Y1—，其中环烷基或环烯基可以选择地被一个或多个羟基或C1-16烷基基团取代；R2代表氢或C1-16烷基；X代表乙烯或公式CReRf的基团，其中Re和Rf独立地代表氢或C1-14烷基，或Re和Rf可以与它们连接的碳原子一起形成C3-8环烷基基团；R3和R4独立地代表氢或C1-14烷基；Z代表键，CO，SO2，CR9R6(CH2)n，(CH2)nCR9R6，CHR6(CH2)nO，CHR6(CH2)nS，CHR6(CH2)nOCO，CHR6(CH2)nCO，COCHR6(CH2)n或SO2CHR6(CH2)n；n代表一个从0到4的整数；它们的制备方法，包含它们的配方以及它们在治疗炎症性疾病中的用途。
• [EN] MORPHOLIN-ACETAMIDE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISEASES<br/>[FR] DERIVES DE MORPHOLINE-ACETAMIDE POUR LE TRAITEMENT DES MALADIES INFLAMMATOIRES
  申请人：GLAXO GROUP LTD

  公开号：WO2003099287A1

  公开（公告）日：2003-12-04

  Compounds of formula I: (I) wherein:R1 represents C3-8 cycloalkyl-Y1-, aryl-Y1-, heteroaryl-Y1-, aryl- G-Y1-, heteroaryl-G-Y1-, C1-6 alkyl-G-Y1-, J1-Y1-, NR21R22-Y1-, NR21R22-CO-Y1- or R23-CONR21-Y1-;Q represents -(CR16R19)(CR18aR19a)t-, wherein t represents an integer from 0 to 3; R2 represents hydrogen or C1-6 alkyl; X represents ethylene or a group of formula CReRf wherein Re and Rf independently represent hydrogen or C1-4 alkyl or Re and Rf may together with the carbon atom to which they are attached form a C3-8 cycloalkyl group; R3 and R4 independently represent hydrogen or C1-4 alkyl; Z represents a bond, CO, SO2, CR9R6(CH2)n, (CH2)nCR9R6, CR9R6(CH2)nO, CR9R6(CH2)nS, CR9R6(CH2)nCO, COCR9R6(CH2)n or SO2CR9R6(CH2)n; R5 represents aryl, heteroaryl or aryl-C2-6 alkenyl-; R6 represents hydrogen, C1-4 alkyl, CONR7R8 or COOC1-6 alkyl; a and b represent 1 or 2, such that a+b represents 2 or 3; G represents -S-, -SO2-, -SO2NR20, -NR20SO2 or -NR20-; n represents an integer from 0 to 4; and salts and solvates thereof are CCR3 receptor antagonists and are thus indicated to be useful in therapy.

  化合物的式子为I：（I）其中：R1代表C3-8环烷基-Y1-，芳基-Y1-，杂芳基-Y1-，芳基-G-Y1-，杂芳基-G-Y1-，C1-6烷基-G-Y1-，J1-Y1-，NR21R22-Y1-，NR21R22-CO-Y1-或R23-CONR21-Y1-;Q代表-(CR16R19)(CR18aR19a)t-，其中t表示0到3的整数；R2代表氢或C1-6烷基；X代表乙烯或式子CReRf的基团，其中Re和Rf独立地代表氢或C1-4烷基，或Re和Rf可以与它们附着的碳原子一起形成C3-8环烷基；R3和R4独立地代表氢或C1-4烷基；Z代表键，CO，SO2，CR9R6(CH2)n，(CH2)nCR9R6，CR9R6(CH2)nO，CR9R6(CH2)nS，CR9R6(CH2)nCO，COCR9R6(CH2)n或SO2CR9R6(CH2)n；R5代表芳基，杂芳基或芳基-C2-6烯基-；R6代表氢，C1-4烷基，CONR7R8或COOC1-6烷基；a和b代表1或2，使得a+b代表2或3；G代表-S-，-SO2-，-SO2NR20，-NR20SO2或-NR20-；n代表0到4的整数；它们的盐和溶剂化物是CCR3受体拮抗剂，因此被认为在治疗中有用。
• [EN] COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES<br/>[FR] COMPOSES UTILES DANS LE TRAITEMENT DE MALADIES INFLAMMATOIRES
  申请人：GLAXO GROUP LTD

  公开号：WO2002026723A1

  公开（公告）日：2002-04-04

  There are provided according to the invention, novel compounds of formula (I) wherein R?1, R2, R3, R4, R5, R6¿, X a, b, and Z are as defined in the specification, processes for preparing them, formulations containing them and their use in therapy for the treatment of inflammatory diseases.

  根据本发明提供了新型化合物(I)的公式，其中R1、R2、R3、R4、R5、R6、X、a、b和Z的定义如规范中所述，制备它们的过程，含有它们的配方以及它们在治疗炎症性疾病中的用途。