HRID1129300

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID6590

2-Methylpropanoic acid

C4H8O2

HCID8471

Triethylamine

C6H15N

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID143452

tert-Butyl piperazine-1-carboxylate

C9H18N2O2

PRODUCTS

生成物

HCID60708297

1,1-Dimethylethyl 4-(2-methyl-1-oxopropyl)-1-piperazinecarboxylate

C13H24N2O3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0fab03b212684a6f8f179644445b47b7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH2:25]([N:26]=[C:27]=[N:28][CH2:29][CH2:30][CH2:31][N:32]([CH3:33])[CH3:34])[CH3:35].[CH3:1][CH:2]([CH3:3])[C:4]([OH:5])=[O:6].[CH3:7][CH2:8][N:9]([CH2:10][CH3:11])[CH2:12][CH3:13].[Cl:49][CH2:50][Cl:51].[ClH:24].[N:36]1([C:42](=[O:43])[O:44][C:45]([CH3:46])([CH3:47])[CH3:48])[CH2:37][CH2:38][NH:39][CH2:40][CH2:41]1.[OH:14][n:15]1[c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]2[n:22][n:23]1>>[CH3:1][CH:2]([CH3:3])[C:4](=[O:6])[N:39]1[CH2:38][CH2:37][N:36]([C:42](=[O:43])[O:44][C:45]([CH3:46])([CH3:47])[CH3:48])[CH2:41][CH2:40]1