HRID314154

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID7854

Propionitrile

C3H5N

HCID19660

Carbonate

CO3-2

HCID30165

Iodide ion

I-

HCID81531

Diisopropylethylamine

C8H19N

HCID723833

4-(N-Boc-amino)piperidine

C10H20N2O2

HCID10514345

未命名化合物

HCID14799468

1-(2-Hydroxyethyl)piperidin-4-ol

C7H15NO2

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1CCN(CCN2CCC(O)CC2)CC1

HCID66841294

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-19b2801ba9384f37b3ecc0ba9b35f226
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]1[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]1)=[O:14].[C:35]([CH2:36][P+:37]([CH3:38])([CH3:39])[CH3:40])#[N:41].[C:42](=[O:43])([O-:44])[O-:45].[C:48](#[N:49])[CH2:50][CH3:51].[CH:25]([N:26]([CH2:27][CH3:28])[CH:29]([CH3:30])[CH3:31])([CH3:32])[CH3:33].[Cl:53][CH2:54][Cl:55].[I-:34].[K+:46].[K+:47].[OH2:52].[OH:15][CH2:16][CH2:17][N:18]1[CH2:19][CH2:20][CH:21]([OH:24])[CH2:22][CH2:23]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]1[CH2:9][CH2:10][N:11]([CH2:16][CH2:17][N:18]2[CH2:19][CH2:20][CH:21]([OH:24])[CH2:22][CH2:23]2)[CH2:12][CH2:13]1)=[O:14]