CAS 1221725-61-6

Carbamic acid, N-[6-(diethylamino)-3-pyridinyl]-, 2,2,2-trifluoroethyl ester

Description:

Carbamic acid, N-[6-(diethylamino)-3-pyridinyl]-, 2,2,2-trifluoroethyl ester, identified by CAS number 1221725-61-6, is a chemical compound that features a carbamic acid functional group linked to a pyridine ring substituted with a diethylamino group. This structure imparts unique properties, including potential biological activity, making it of interest in medicinal chemistry. The presence of the trifluoroethyl ester moiety enhances lipophilicity, which may influence its pharmacokinetic profile. The compound is likely to exhibit moderate to high stability under standard conditions, although the trifluoroethyl group may confer some reactivity due to the electronegative fluorine atoms. Its solubility characteristics would typically be influenced by the polar and nonpolar components of its structure. As with many nitrogen-containing heterocycles, it may participate in hydrogen bonding, affecting its interactions with biological targets. Safety and handling considerations should be taken into account, as with all chemical substances, particularly those with potential biological activity. Further studies would be necessary to elucidate its specific applications and mechanisms of action.

Formula: C₁₂H₁₆F₃N₃O₂

InChI: InChI=1S/C12H16F3N3O2/c1-3-18(4-2)10-6-5-9(7-16-10)17-11(19)20-8-12(13,14)15/h5-7H,3-4,8H2,1-2H3,(H,17,19)

InChI key: InChIKey=AJELHUYWTNVSIX-UHFFFAOYSA-N

SMILES: N(CC)(CC)C1=CC=C(NC(OCC(F)(F)F)=O)C=N1

Synonyms:

• 2,2,2-Trifluoroethyl N-(6-diethylaminopyridin-3-yl)carbamate
• Carbamic acid, N-[6-(diethylamino)-3-pyridinyl]-, 2,2,2-trifluoroethyl ester

2,2,2-Trifluoroethyl N-[6-(diethylamino)pyridin-3-yl]carbamate

CAS: 1221725-61-6

Versatile small molecule scaffold

Formula: C₁₂H₁₆F₃N₃O₂

Purity: Min. 95%

Molecular weight: 291.27 g/mol

Ref: 3D-WYB72561