Tools Molecules Reactions Blog

Sign in

Compound database

Compounds similar to this structure

CC[Al](CC)C#NEdit in Covalent

2 compounds score at least 30 % on Tanimoto similarity of circular fingerprints, most similar first.

Aryl halide10,594 Ether8,665 Carboxylic acid7,810 Primary amine6,334 Alcohol6,116 Ester5,565 Alkyl halide4,988 Alkene4,963 Phenol4,105 Ketone3,626 Tertiary amine3,197 Secondary amine2,898

Show all 52

Amide2,627 Nitro2,386 Nitrile1,806 Carbamate1,659 Acetal1,499 Aldehyde1,459 Sulfide1,238 Lactam1,122 Sulfonic acid832 Boronic acid677 Sulfonamide568 Thiol557 Lactone527 Alkyne443 Phosphate437 Acyl halide426 Quaternary ammonium365 Guanidine336 Sulfone326 Epoxide299 Boronic ester289 Silyl ether266 Oxime252 Imine236 Phosphine236 Vinyl halide231 Azo227 Hydrazone215 Isothiocyanate193 Amidine191 Acid anhydride185 Phosphonate176 Isocyanate165 Disulfide160 Sulfonate ester141 Carbonate136 Urea135 Sulfoxide64 Peroxide62 Azide55

Diethylaluminium cyanide5804-85-3100 % similar Ethyl thiocyanate542-90-530 % similar

© 2026 Chempirical · Free tools for chemists

All tools API Blog SDS library Contact