Ethylenediamine → 5-(2,6-diethyl-phenyl)-1-(4-isopropyl-phenyl)-1H-pyrrolo[2,3-c]pyridine

HRID 1543837Notes

Reaction equation

HRID 1543837 reaction equation
[C:30](=[O:31])([O-:32])[O-:33].[CH2:1]([CH3:2])[c:3]1[c:4](-[c:11]2[cH:12][c:13]3[c:14]([cH:15][n:16]2)[nH:17][cH:18][cH:19]3)[c:5]([CH2:9][CH3:10])[cH:6][cH:7][cH:8]1.[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[Cs+:34].[Cs+:35].[Cu:52][I:53].[I:20][c:21]1[cH:22][cH:23][c:24]([CH:27]([CH3:28])[CH3:29])[cH:25][cH:26]1.[NH2:36][CH2:37][CH2:38][NH2:39].[O:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1>>[CH2:1]([CH3:2])[c:3]1[c:4](-[c:11]2[cH:12][c:13]3[c:14]([cH:15][n:16]2)[n:17](-[c:21]2[cH:22][cH:23][c:24]([CH:27]([CH3:28])[CH3:29])[cH:25][cH:26]2)[cH:18][cH:19]3)[c:5]([CH2:9][CH3:10])[cH:6][cH:7][cH:8]1

Participants

9

Reactant 8

HCID 3301EthylenediamineHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 312751,4-DioxaneHCID 87073p-IodocumeneHCID 104967Cesium cation2×HCID 116732465-(2,6-diethyl-phenyl)-1H-pyrrolo[2,3-c]pyridine

Product 1

HCID 582699455-(2,6-diethyl-phenyl)-1-(4-isopropyl-phenyl)-1H-pyrrolo[2,3-c]pyridine

Sources & evidence

ORD record
ord-bdd5a8fa624c40e18811cc4ca493d044
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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