4-(6-Phenylpyridin-3-YL)pyrimidin-2-amine

Base Information

• Chemical Name: 4-(6-Phenylpyridin-3-YL)pyrimidin-2-amine
• CAS No.: 1048004-08-5
• Molecular Formula: C₁₅H₁₂N₄
• Molecular Weight: 248.287
• DSSTox Substance ID: DTXSID60695032
• Wikidata: Q82624016
• Mol file: 1048004-08-5.mol

Synonyms:1048004-08-5;4-(6-PHENYLPYRIDIN-3-YL)PYRIMIDIN-2-AMINE;4-(6-Phenylpyridin-3-yl)-pyrimidin-2-ylamine;4-(6-Phenyl-pyridin-3-yl)-pyrimidin-2-ylamine;DTXSID60695032;MFCD17926255

Chemical Property of 4-(6-Phenylpyridin-3-YL)pyrimidin-2-amine

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 248.106196400
• Heavy Atom Count: 19
• Complexity: 277

Purity/Quality:

97% ^*data from raw suppliers

4-(6-Phenylpyridin-3-yl)-pyrimidin-2-ylamine 95%+ ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-(6-Phenylpyridin-3-YL)pyrimidin-2-amine

There total 2 articles about 4-(6-Phenylpyridin-3-YL)pyrimidin-2-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: 84.0%

3-dimethylamino-1-(6-phenylpyridin-3-yl)prop-2-en-1-one (1048004-06-3) + guanidine hydrochloride (50-01-1) → 4-(6-phenylpyridin-3-yl)pyrimidin-2-amine (1048004-08-5)

Guidance literature:

With sodium ethanolate; In ethanol; for 5h; Heating;

DOI:10.3390/molecules13040818

Reference yield: 83.5%

3-(dimethylamino)-1-(6-phenylpyridin-3-yl)prop-2-en-1-one (1234327-08-2) + guanidine hydrochloride (50-01-1) → 4-(6-phenylpyridin-3-yl)pyrimidin-2-amine (1048004-08-5)

Guidance literature:

guanidine hydrochloride; With ethanol; sodium ethanolate; at 20 ℃; for 1h;

3-(dimethylamino)-1-(6-phenylpyridin-3-yl)prop-2-en-1-one; In ethanol; for 5h; Reflux;

DOI:10.1016/j.bmc.2010.04.037

Reference yield: 82.0%

1-bromo-4-methoxy-benzene (104-92-7) + 4-(6-phenylpyridin-3-yl)pyrimidin-2-amine (1048004-08-5) → N-(4-methoxyphenyl)-4-(6-phenylpyridin-3-yl)pyrimidin-2-amine (1048004-10-9)

Guidance literature:

With 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; sodium t-butanolate; bis-triphenylphosphine-palladium(II) chloride; In toluene; for 8h; Heating;

DOI:10.3390/molecules13040818

upstream raw materials:

3-dimethylamino-1-(6-phenylpyridin-3-yl)prop-2-en-1-one

guanidine hydrochloride

3-(dimethylamino)-1-(6-phenylpyridin-3-yl)prop-2-en-1-one

Downstream raw materials:

N-(4-methoxyphenyl)-4-(6-phenylpyridin-3-yl)pyrimidin-2-amine

N₁,N₁-diphenyl-N₄-(4-(6-phenylpyridin-3-yl)pyrimidin-2-yl)benzene-1,4-diamine

N-(3,5-bis(trifluoromethyl)phenyl)-4-(6-phenylpyridin-3-yl)pyrimidin-2-amine