1,1-Dichloroethane → 2-(cyclohexylamino)-6-fluoro-N-(1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-7-yl)nicotinamide

HRID 290325

Reaction equation

HRID 290325 reaction equation
[CH3:59][CH2:60][N:61]([CH2:62][CH3:63])[CH2:64][CH3:65].[CH:29]1([NH:35][c:36]2[c:37]([C:38](=[O:39])[OH:40])[cH:41][cH:42][c:43]([F:45])[n:44]2)[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]1.[Cl:25][CH:26]([Cl:27])[CH3:28].[NH2:46][c:47]1[cH:48][cH:49][c:50]2[c:55]([cH:56]1)[N:54]([CH3:57])[C:53](=[O:58])[CH2:52][CH2:51]2.[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[CH:29]1([NH:35][c:36]2[c:37]([C:38](=[O:40])[NH:46][c:47]3[cH:48][cH:49][c:50]4[c:55]([cH:56]3)[N:54]([CH3:57])[C:53](=[O:58])[CH2:52][CH2:51]4)[cH:41][cH:42][c:43]([F:45])[n:44]2)[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]1

Participants

7

Reactant 6

HCID 63651,1-DichloroethaneHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 336993947-amino-1-methyl-3,4-dihydroquinolin-2(1H)-oneHCID 667038262-(Cyclohexylamino)-6-fluoronicotinic acid

Product 1

HCID 667038732-(cyclohexylamino)-6-fluoro-N-(1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-7-yl)nicotinamide

Sources & evidence

ORD record
ord-1e63e16cb0e949ed8e8fe5409f3df983
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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