Potassium Cation → Methyl 4-(2-(3-(4-ethoxypiperidine-1-carbonyl)-4-fluorophenyl)acetyl)-1,2,5-trimethyl-1H-pyrrole-3-carboxylate

HRID 2127830Notes

Reaction equation

HRID 2127830 reaction equation
[C:35](=[O:36])([O-:37])[O-:38].[CH2:3]([CH3:4])[O:5][CH:6]1[CH2:7][CH2:8][N:9]([C:12](=[O:13])[c:14]2[cH:15][c:16]([CH2:21][C:22](=[O:23])[c:24]3[c:25]([C:31](=[O:32])[O:33][CH3:34])[c:26]([CH3:30])[nH:27][c:28]3[CH3:29])[cH:17][cH:18][c:19]2[F:20])[CH2:10][CH2:11]1.[I:1][CH3:2].[K+:39].[K+:40].[O:42]=[CH:43][N:44]([CH3:45])[CH3:46].[OH2:41]>>[CH2:3]([CH3:4])[O:5][CH:6]1[CH2:7][CH2:8][N:9]([C:12](=[O:13])[c:14]2[cH:15][c:16]([CH2:21][C:22](=[O:23])[c:24]3[c:25]([C:31](=[O:32])[O:33][CH3:34])[c:26]([CH3:30])[n:27]([CH3:35])[c:28]3[CH3:29])[cH:17][cH:18][c:19]2[F:20])[CH2:10][CH2:11]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 6328Methyl iodideHCID 19660Carbonate IonHCID 57791805methyl 4-(2-(3-(4-ethoxypiperidine-1-carbonyl)-4-fluorophenyl)acetyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

Product 1

HCID 57791827Methyl 4-(2-(3-(4-ethoxypiperidine-1-carbonyl)-4-fluorophenyl)acetyl)-1,2,5-trimethyl-1H-pyrrole-3-carboxylate

Sources & evidence

ORD record
ord-1717d19bc95844ecbbbccaccbf9b63e0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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