Dichloromethane → 1-[2-(4-Aminopiperidin-1-yl)ethyl]-6,7-dimethoxyquinoxalin-2(1H)-one

HRID 2127059Notes

Reaction equation

HRID 2127059 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]2[n:6][cH:7][c:8](=[O:31])[n:9]([CH2:15][CH2:16][N:17]3[CH2:18][CH2:19][CH:20]([NH:23][C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:21][CH2:22]3)[c:10]2[cH:11][c:12]1[O:13][CH3:14].[Cl:60][CH2:61][Cl:62].[NH2:39][CH:40]1[CH2:41][CH2:42][N:43]([CH2:44][CH2:45][n:46]2[c:47]3[c:48]([cH:49][cH:50][c:51]([F:52])[cH:53]3)[n:54][cH:55][c:56]2=[O:57])[CH2:58][CH2:59]1.[OH:32][C:33]([C:34]([F:35])([F:36])[F:37])=[O:38]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[n:6][cH:7][c:8](=[O:31])[n:9]([CH2:15][CH2:16][N:17]3[CH2:18][CH2:19][CH:20]([NH2:23])[CH2:21][CH2:22]3)[c:10]2[cH:11][c:12]1[O:13][CH3:14]

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 593979071-(2-(4-aminopiperidin-1-yl)ethyl)-7-fluoroquinoxalin-2(1H)-oneHCID 86642646tert-Butyl{1-[2-(6,7-dimethoxy-2-oxoquinoxalin-1(2H)-yl)ethyl]piperidin-4-yl}carbamate

Product 1

HCID 667747511-[2-(4-Aminopiperidin-1-yl)ethyl]-6,7-dimethoxyquinoxalin-2(1H)-one

Sources & evidence

ORD record
ord-9e35da30120140369cc79cbe00031527
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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