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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2403632Generated: October 31, 2026

Sodium Cyanide → 4-[(1-Cyanocyclobutyl)amino]-2-fluoro-N-methylbenzamide

https://huagongshe.com/reaction/2403632

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium CyanideHCID 8929—
ReactantCyclobutanoneHCID 14496—
Reactant4-Amino-2-fluoro-N-methylbenzamideHCID 44139521—
SolventAcetic AcidHCID 176—
Product4-[(1-Cyanocyclobutyl)amino]-2-fluoro-N-methylbenzamideHCID 44139520—

Reaction Conditions

Temperature80 °C

Reaction Steps

Sodium cyanide (1.47 g, 30 mmol) was added to a mixture of N-methyl 4-amino-2-fluorobenzamide (1.68 g, 10 mmol) and cyclobutanone (1.4 g, 20 mmol) in 90% acetic acid (20 ml). The reaction mixture was stirred at 80° C. for 24 hours. The mixture was washed with water and extracted with ethyl acetate. The organic layer was dried over magnesium sulfate and concentrated to dryness under vacuum. The solid was washed with a 50:50 mixture of ethyl ether and hexane (10 ml) to remove cyclobutanone cyanohydrin to afford after filtration B2 (2.19 g, 8.87 mmol, 89%). 1H NMR (CDCl3, 400 MHz) δ 1.87-1.95 (m, 1H), 2.16-2.27 (m, 1H), 2.35-2.41 (m, 2H), 2.76-2.83 (m, 2H), 2.97 (d, J=4.4 Hz, 3H), 4.68 (bs, 1H), 6.29 (dd, J=14.3, 1.8 Hz, 1H), 6.48 (dd, J=8.3, 1.8 Hz, 1H), 6.75 (q, J=4.4 Hz, 1H), 7.90 (dd, J=8.3, 8.3 Hz, 1H); 13C NMR (CDCl3, 100 MHz) δ 15.7, 26.7, 33.9, 49.4, 100.2 (d, J=29.5 Hz), 110.6, 111.0 (d, J=11.8 Hz), 133.1 (d, J=4.2 Hz), 148.4 (d, J=12.0 Hz), 162.0 (d, J=244.1 Hz), 164.4 (d, J=3.6 Hz).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08802689B2
Source datasetuspto-grants-2014_08
ORD IDord-e04b7fe8118d4033a9e2288984372619
Source noteuspto-grants-2014_08