3-Cyclobutyl-1-phenyl-1H-pyrazol-5-amine

Base Information

• Chemical Name: 3-Cyclobutyl-1-phenyl-1H-pyrazol-5-amine
• CAS No.: 187795-44-4
• Molecular Formula: C13H15N3
• Molecular Weight: 213.2783
• DSSTox Substance ID: DTXSID501275621
• Mol file: 187795-44-4.mol

Synonyms:3-Cyclobutyl-1-phenyl-1H-pyrazol-5-amine;187795-44-4;5-cyclobutyl-2-phenylpyrazol-3-amine;DIMETHYLETHYLPHOSPHONITE;SCHEMBL1013974;FFTUPFXYVRUGKW-UHFFFAOYSA-N;DTXSID501275621;MFCD11105318;AKOS009336073;3-Cyclobutyl-phenyl-1H-pyrazol-5-amine;AS-62864;CS-0036115;EN300-115308;W13479;Z385403902

Chemical Property of 3-Cyclobutyl-1-phenyl-1H-pyrazol-5-amine

Chemical Property:

• PSA: 0.00000
• LogP: 0.00000
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 213.126597491
• Heavy Atom Count: 16
• Complexity: 233

Purity/Quality:

97% ^*data from raw suppliers

5-cyclobutyl-2-phenylpyrazol-3-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CC(C1)C2=NN(C(=C2)N)C3=CC=CC=C3

Technology Process of 3-Cyclobutyl-1-phenyl-1H-pyrazol-5-amine

There total 1 articles about 3-Cyclobutyl-1-phenyl-1H-pyrazol-5-amine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

phenylhydrazine hydrochloride (59-88-1) + β-Cyclobutyl-β-oxopropionitrile (118431-89-3) → 5-cyclobutyl-2-phenyl-2H-pyrazol-3-ylamine (187795-44-4)

Guidance literature:

In ethanol; for 1h; Reflux;

Reference yield:

5-cyclobutyl-2-phenyl-2H-pyrazol-3-ylamine (187795-44-4) + ethyl (E)-4-[6-(4-cyano-1-piperidyl)-3-pyridyl]-2-oxo-but-3-enoate → ethyl 4-[6-(4-cyano-1-piperidyl)-3-pyridyl]-3-cyclobutyl-1-phenylpyrazolo[3,4-b]pyridine-6-carboxylate

Guidance literature:

With acetic acid; at 80 ℃; for 40h;

Reference yield:

5-cyclobutyl-2-phenyl-2H-pyrazol-3-ylamine (187795-44-4) + diethyl malonate (105-53-3) → 3-cyclobutyl-1-phenyl-pyrazolo[3,4-b]pyridine-4,6-diol

Guidance literature:

In diphenylether; at 130 - 150 ℃; for 40h;

upstream raw materials:

phenylhydrazine hydrochloride

β-Cyclobutyl-β-oxopropionitrile

Downstream raw materials:

C₂₀H₁₉ClN₄O

C₂₁H₁₉F₃N₄O

C₂₀H₁₉BrN₄O

C₂₀H₁₈ClFN₄O

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