6-Chloro-N4-(cyclopropylmethyl)pyrimidine-4,5-diamine

Base Information

• Chemical Name: 6-Chloro-N4-(cyclopropylmethyl)pyrimidine-4,5-diamine
• CAS No.: 195252-60-9
• Molecular Formula: C₈H₁₁ClN₄
• Molecular Weight: 198.655
• DSSTox Substance ID: DTXSID801212125
• Mol file: 195252-60-9.mol

Synonyms:6-CHLORO-N4-(CYCLOPROPYLMETHYL)PYRIMIDINE-4,5-DIAMINE;195252-60-9;6-chloro-4-n-(cyclopropylmethyl)pyrimidine-4,5-diamine;6-Chloro-N4-cyclopropylMethyl-pyriMidine-4,5-diaMine;SCHEMBL12590817;DTXSID801212125;AMY21161;AKOS012321883;SB56419;6-Chloro-N4-(cyclopropylmethyl)-4,5-pyrimidinediamine

Chemical Property of 6-Chloro-N4-(cyclopropylmethyl)pyrimidine-4,5-diamine

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 198.0672241
• Heavy Atom Count: 13
• Complexity: 174

Purity/Quality:

99% ^*data from raw suppliers

6-Chloro-N4-(cyclopropylmethyl)pyrimidine-4,5-diamine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CC1CNC2=C(C(=NC=N2)Cl)N

Technology Process of 6-Chloro-N4-(cyclopropylmethyl)pyrimidine-4,5-diamine

There total 3 articles about 6-Chloro-N4-(cyclopropylmethyl)pyrimidine-4,5-diamine 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: 92.0%

5-amino-4,6-dichloropyridimine (5413-85-4) + cyclopropanemethylamine (2516-47-4) → 6-Chloro-N4-cyclopropylmethyl-pyrimidine-4,5-diamine (195252-60-9)

Guidance literature:

With triethylamine; In ethanol; at 80 - 100 ℃;

DOI:10.1021/acs.jafc.1c01651

Reference yield: 92.0%

→ 6-Chloro-N4-cyclopropylmethyl-pyrimidine-4,5-diamine (195252-60-9)

Guidance literature:

With triethylamine; In ethanol; at 100 ℃;

Reference yield: 53.0%

4-chloro-1H-pyrrolo[2,3-d]pyrimidine (3680-69-1) + cyclopropanemethylamine (2516-47-4) → 6-Chloro-N4-cyclopropylmethyl-pyrimidine-4,5-diamine (195252-60-9)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In 1,4-dioxane; for 16h; Heating / reflux;

upstream raw materials:

5-amino-4,6-dichloropyridimine

cyclopropanemethylamine

4-chloro-1H-pyrrolo[2,3-d]pyrimidine

Downstream raw materials:

6-Chloro-9-cyclopropylmethyl-9H-purine

Cyclopropyl-(9-cyclopropylmethyl-9H-purin-6-yl)-amine