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Triethylamine → N1-(2-cyclopentylethyl)-4-methyl-N3-(6-(3-methylbutanamido)pyridin-3-yl)isophthalamide

HRID 2355104
ノート
印刷プレビュー

反応式

HRID 2355104 の反応式
[NH2:1][C:2]1[N:7]=[CH:6][C:5]([NH:8][C:9](=[O:27])[C:10]2[CH:11]=[C:12]([CH:23]=[CH:24][C:25]=2[CH3:26])[C:13]([NH:15][CH2:16][CH2:17][CH:18]2[CH2:22][CH2:21][CH2:20][CH2:19]2)=[O:14])=[CH:4][CH:3]=1.C(N(CC)CC)C.[C:35](Cl)(=[O:40])[CH2:36][CH:37]([CH3:39])[CH3:38]>O>[CH:18]1([CH2:17][CH2:16][NH:15][C:13](=[O:14])[C:12]2[CH:23]=[CH:24][C:25]([CH3:26])=[C:10]([C:9]([NH:8][C:5]3[CH:6]=[N:7][C:2]([NH:1][C:35](=[O:40])[CH2:36][CH:37]([CH3:39])[CH3:38])=[CH:3][CH:4]=3)=[O:27])[CH:11]=2)[CH2:22][CH2:21][CH2:20][CH2:19]1
参加物反応条件実験手順後処理出典と根拠反応ノート

参加物

5

反応物 3

HCID 8471TriethylamineHCID 66054Isovaleryl chlorideHCID 24812718N'-(6-aminopyridin-3-yl)-N-(2-cyclopentylethyl)-4-methyl-benzene-1,3-dicarboxamide

生成物 1

HCID 59381892N1-(2-cyclopentylethyl)-4-methyl-N3-(6-(3-methylbutanamido)pyridin-3-yl)isophthalamide

試薬・触媒・溶媒 1

HCID 962Water溶媒

反応条件

温度
0 °C

実験手順

To a 25 mL round-bottomed flask was added N3-(6-aminopyridin-3-yl)-N1-(2-cyclopentylethyl)-4-methylisophthalamide (0.19 g, 0.52 mmol) and Triethylamine (0.18 ml, 1.3 mmol) to stir at 0° C. Isovaleryl chloride (0.14 ml, 1.0 mmol) was added to the solution dropwise. The reaction was allowed to stir for one hour. At which time was shown to be at completion by LC/MS. DI water was added to the reaction. The reaction was transferred to a separatory funnel, where the aqueous layer was extracted 3 times with DCM. The combined organic layers were washed with brine, saturated NaHCO3, dried with MgSO4, filtered, and concentrated. The crude product was adsorbed onto a plug of silica gel and chromatographed through a Biotage pre-packed silica gel column (25M), eluting with a gradient of 1% to 10% MeOH in CH2Cl2, to provide N1-(2-cyclopentylethyl)-4-methyl-N3-(6-(3-methylbutanamido)pyridin-3-yl)isophthalamide as a white solid. MS (ESI, pos. ion) m/z: 451.3 (M+1).

後処理

  1. stirringto stir for one hour
  2. customThe reaction was transferred to a separatory funnel
  3. extractionwhere the aqueous layer was extracted 3 times with DCM
  4. washThe combined organic layers were washed with brine, saturated NaHCO3
  5. dry with materialdried with MgSO4
  6. filtrationfiltered
  7. concentrationconcentrated
  8. customchromatographed through a Biotage pre-packed silica gel column (25M)
  9. washeluting with a gradient of 1% to 10% MeOH in CH2Cl2

出典と根拠

ORDレコード
ord-5410ba5eadad4335ad200d59cf81c331
出典データセット
uspto-grants-2010_07
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07754717B2

反応ノート

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