HRID1121917

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

HCID31275

1,4-Dioxane

C4H8O2

HCID285645

4-Fluorophenylboronic acid

C6H6BFO2

HCID10749704

3-amino-6-chloropicolinamide

C6H6ClN3O

PRODUCTS

生成物

HCID59647906

3-Amino-6-(4-fluorophenyl)pyridine-2-carboxamide

C12H10FN3O

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-91d9fe816547429aa497c20e2ee49623
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

[K+:22].[K+:23].[NH2:1][c:2]1[c:3]([C:9](=[O:10])[NH2:11])[n:4][c:5]([Cl:8])[cH:6][cH:7]1.[O-:24][C:25]([O-:26])=[O:27].[O:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1.[OH2:34].[OH:12][B:13]([OH:14])[c:15]1[cH:16][cH:17][c:18]([F:19])[cH:20][cH:21]1.[Pd:35].[c:36]1([P:37]([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[cH:50][cH:51][cH:52][cH:53][cH:54]1.[c:55]1([P:56]([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[cH:69][cH:70][cH:71][cH:72][cH:73]1.[c:74]1([P:75]([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[cH:88][cH:89][cH:90][cH:91][cH:92]1.[c:93]1([P:94]([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[cH:107][cH:108][cH:109][cH:110][cH:111]1>>[NH2:1][c:2]1[c:3]([C:9](=[O:10])[NH2:11])[n:4][c:5](-[c:15]2[cH:16][cH:17][c:18]([F:19])[cH:20][cH:21]2)[cH:6][cH:7]1