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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 887313Generated: October 24, 2026

2-(Isoquinolin-5-YL)acetic acid → N-[4-(1-azepanyl)-3-fluorobenzyl]-2-(5-isoquinolinyl)butanamide

https://huagongshe.com/en/reaction/887313

Reaction equation

Participants

RoleNameHCIDCharge
Reactant2-(Isoquinolin-5-YL)acetic acidHCID 12018708—
Reactant4-(1-Azepanyl)-3-fluorobenzylamineHCID 22337567—
Reactant2-(Isoquinolin-5-yl)butanoic acidHCID 22337682—
ProductN-[4-(1-azepanyl)-3-fluorobenzyl]-2-(5-isoquinolinyl)butanamideHCID 11293041—

Reaction Steps

The title compound was prepared using the procedure described in Example 222B using 4-(1-azepanyl)-3-fluorobenzylamine and 2-(5-isoquinolinyl)butanoic acid instead of 4-(trifluoromethoxy)benzylamine and 5-isoquinolinylacetic acid. MS (ESI+) m/z 420 (M+H)+; MS (ESI−) m/z 418 (M−H)−; 1H NMR (DMSO, 300 MHz) δ 0.90 (t, J 7.5, 3H), δ 1.55 (m, 4H), 1.76 (m, 6H), 2.20 (m, 1H), 3.34 (m, 5H), 4.18 (m, 2H), 6.81 (m, 1H), 7.62 (m, 1H), 8.00 (m, 2H), 8.27 (d, J 7.1, 1H), 8.45 (d, 1H), 8.77 (d, 1H), 8.82 (m, 1H), 9.90 (s, 1H), 10.18 (br s, 1H); Anal. Calcd for C26H30FN3O+0.45H2O: C, 73.02; H, 7.28. Found: C, 73.05; H, 7.20.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08247413B2
Source datasetuspto-grants-2012_08
ORD IDord-0d752ab615964e798f8a33c841fc0ad9
Source noteuspto-grants-2012_08