Diethyl Ether → 4-amino-N-(1-(4-chlorophenyl)-4-(dimethylamino)butyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

HRID 1232127Notes

Reaction equation

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

Participants

Reactant 4

HCID 3283Diethyl Ether

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 66673745tert-butyl 4-(1-(4-chlorophenyl)-4-(dimethylamino)butylcarbamoyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-4-ylcarbamate

Product 1

HCID 426022644-amino-N-(1-(4-chlorophenyl)-4-(dimethylamino)butyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

Sources & evidence

ORD record: ord-0f89d8a32b434437827447daa6a3cab2
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…