3-Prop-2-enoxycyclopentan-1-amine → 3-amino-4-(3,5-difluorophenyl)-1-[(3-prop-2-enoxycyclopentyl)amino]butan-2-ol

HRID 139752Notes

Reaction equation

HRID 139752 reaction equation
[CH2:1]([O:2][CH:3]1[CH2:4][CH2:5][CH:6]([NH2:7])[CH2:8]1)[CH:9]=[CH2:10].[CH2:35]([CH:36]=[CH2:37])[O:38][CH:39]1[CH2:40][CH:41]([NH:44][CH2:45][CH:46]([CH:47]([CH2:48][c:49]2[cH:50][c:51]([F:56])[cH:52][c:53]([F:55])[cH:54]2)[NH:57][C:58](=[O:59])[O:60][CH2:61][c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[OH:68])[CH2:42][CH2:43]1.[CH2:69]([O:70][CH:71]1[CH2:72][CH2:73][CH:74]([NH:75][CH2:76][CH:77]([OH:78])[CH:79]([NH:80][C:81](=[O:82])[O:83][CH2:84][c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)[CH2:91][c:92]2[cH:93][c:94]([F:95])[cH:96][c:97]([F:98])[cH:99]2)[CH2:100]1)[CH:101]=[CH2:102].[F:11][c:12]1[cH:13][c:14]([CH2:15][CH:16]([NH:17][C:18](=[O:19])[O:20][CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[CH:28]2[CH2:29][O:30]2)[cH:31][c:32]([F:33])[cH:34]1>>[CH2:35]([CH:36]=[CH2:37])[O:38][CH:39]1[CH2:40][CH:41]([NH:44][CH2:45][CH:46]([CH:47]([CH2:48][c:49]2[cH:50][c:51]([F:56])[cH:52][c:53]([F:55])[cH:54]2)[NH2:57])[OH:68])[CH2:42][CH2:43]1

Participants

4

Reactant 3

HCID 684637753-Prop-2-enoxycyclopentan-1-amineHCID 72432655benzyl N-[2-(3,5-difluorophenyl)-1-(oxiran-2-yl)ethyl]carbamateHCID 178458512HCID 178458512, compound2×

Product 1

HCID 1784585133-amino-4-(3,5-difluorophenyl)-1-[(3-prop-2-enoxycyclopentyl)amino]butan-2-ol

Sources & evidence

ORD record
ord-a2fb9666222740ae900fc8c7a0bd80f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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