4-Isopropylaniline → HCID 178439246, compound

HRID 1572757Notes

Reaction equation

HRID 1572757 reaction equation
[C:1](=[O:2])([OH:3])[C:4]12[CH2:5][CH2:6][C:7]([NH:12][CH2:13][C:14](=[O:15])[N:16]3[CH:17]([C:22]#[N:23])[CH2:18][CH:19]([F:21])[CH2:20]3)([CH2:8][CH2:9]1)[CH2:10][CH2:11]2.[CH:24]([CH3:25])([CH3:26])[c:27]1[cH:28][cH:29][c:30]([NH2:31])[cH:32][cH:33]1>>[C:1](=[O:3])([C:4]12[CH2:5][CH2:6][C:7]([NH:12][CH2:13][C:14](=[O:15])[N:16]3[CH:17]([C:22]#[N:23])[CH2:18][CH:19]([F:21])[CH2:20]3)([CH2:8][CH2:9]1)[CH2:10][CH2:11]2)[NH:31][c:30]1[cH:29][cH:28][c:27]([CH:24]([CH3:25])[CH3:26])[cH:33][cH:32]1

Participants

3

Reactant 2

HCID 74644-IsopropylanilineHCID 231496734-[[2-(2-Cyano-4-fluoropyrrolidin-1-yl)-2-oxoethyl]amino]bicyclo[2.2.2]octane-1-carboxylic acid

Product 1

HCID 178439246HCID 178439246, compound

Sources & evidence

ORD record
ord-8f441b19f20649a7be81862dd65a43df
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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