CAS 1004643-49-5

5-Methyl-1-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrazol-3-amine

Description:

5-Methyl-1-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrazol-3-amine is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. The presence of a methyl group at the 5-position and a trifluoromethyl-substituted phenyl group at the 1-position contributes to its unique properties. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its trifluoromethyl group enhances lipophilicity and can influence biological activity, making it of interest in pharmaceutical research. The amine functional group can participate in hydrogen bonding, affecting its reactivity and interactions with other molecules. Additionally, the compound may exhibit specific spectral characteristics in techniques such as NMR and IR spectroscopy, which can be used for its identification and characterization. Overall, 5-Methyl-1-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrazol-3-amine is a compound of interest in medicinal chemistry, potentially serving as a lead structure for drug development.

Formula: C₁₂H₁₂F₃N₃

InChI: InChI=1S/C12H12F3N3/c1-8-5-11(16)17-18(8)7-9-3-2-4-10(6-9)12(13,14)15/h2-6H,7H2,1H3,(H2,16,17)

InChI key: InChIKey=GAYJVRYWRNUKOD-UHFFFAOYSA-N

SMILES: C(N1N=C(N)C=C1C)C2=CC(C(F)(F)F)=CC=C2

Synonyms:

• 1H-Pyrazol-3-amine, 5-methyl-1-[[3-(trifluoromethyl)phenyl]methyl]-
• 5-Methyl-1-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrazol-3-amine

5-Methyl-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazol-3-amine

CAS: 1004643-49-5

Versatile small molecule scaffold

Formula: C₁₂H₁₂F₃N₃

Purity: Min. 95%

Molecular weight: 255.24 g/mol

Ref: 3D-EQB64349