Tetrahydrofuran → N-[3,5-Bis(trifluoromethyl)benzyl]-5-(4-fluorophenyl)-1,2,7,8-tetrahydro-N,1,7-trimethyl-2,8-dioxo-6-pyrido [3,4-b]pyridinecarboxamide

HRID 204245Notes

Reaction equation

HRID 204245 reaction equation
[CH2:41]1[CH2:44][CH2:43][CH2:42][O:45]1.[F:2][C:3]([c:4]1[cH:5][c:6]([CH2:7][N:8]([CH3:9])[C:10](=[O:11])[c:12]2[c:13](-[c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[c:14]3[c:15]([n+:16]([CH3:20])[cH:17][cH:18][cH:19]3)[c:21](=[O:24])[n:22]2[CH3:23])[cH:32][c:33]([C:35]([F:36])([F:37])[F:38])[cH:34]1)([F:39])[F:40].[I-:1].[K:46].[N:47]#[C:48][Fe-3:49]([C:50]#[N:51])([C:52]#[N:53])([C:54]#[N:55])([C:56]#[N:57])[C:58]#[N:59]>>[F:2][C:3]([c:4]1[cH:5][c:6]([CH2:7][N:8]([CH3:9])[C:10](=[O:11])[c:12]2[c:13](-[c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[c:14]3[c:15]([n:16]([CH3:20])[c:17](=[O:45])[cH:18][cH:19]3)[c:21](=[O:24])[n:22]2[CH3:23])[cH:32][c:33]([C:35]([F:36])([F:37])[F:38])[cH:34]1)([F:39])[F:40]

Participants

6

Reactant 5

HCID 8028TetrahydrofuranHCID 30165Iodide IonHCID 5462222PotassiumHCID 23364051N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-(4-fluorophenyl)-N,1,7-trimethyl-8-oxo-1,7-naphthyridin-1-ium-6-carboxamideHCID 178511487HCID 178511487, compound

Product 1

HCID 22355428N-[3,5-Bis(trifluoromethyl)benzyl]-5-(4-fluorophenyl)-1,2,7,8-tetrahydro-N,1,7-trimethyl-2,8-dioxo-6-pyrido [3,4-b]pyridinecarboxamide

Sources & evidence

ORD record
ord-49bee5395b04483f8c6ce06af5f17c93
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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