6-(piperidin-1-yl)-9H-purine

Base Information

• Chemical Name: 6-(piperidin-1-yl)-9H-purine
• CAS No.: 1928-81-0
• Molecular Formula: C10H13 N5
• Molecular Weight: 203.247
• Hs Code.: 2933990090
• NSC Number: 20104
• DSSTox Substance ID: DTXSID60389606
• Nikkaji Number: J2.470.673G
• Wikidata: Q82185552
• ChEMBL ID: CHEMBL264666
• Mol file: 1928-81-0.mol

Synonyms:1928-81-0;6-(piperidin-1-yl)-9H-purine;6-piperidin-1-yl-7H-purine;6-Piperidino-1-purine;6-PIPERIDINOPURINE;MLS000104087;6-(piperidin-1-yl)-7H-purine;6-Piperidino-9H-purine;9H-Purine, 6-(1-piperidinyl)-;SMR000015510;6-piperidino-7H-purine;Oprea1_148697;Oprea1_788909;6-(1-piperidinyl)-7H-purine;CHEMBL264666;IFLab1_000330;SCHEMBL3287249;SCHEMBL8939237;6-(piperidin-1-yl)-1h-purine;BDBM37924;cid_3129049;DTXSID60389606;HMS1412O22;HMS2250I03;NSC20104;NSC-20104;STK844789;AKOS001428034;IDI1_008549;BS-49047;FT-0633920;F74289;Z372953988

Chemical Property of 6-(piperidin-1-yl)-9H-purine

Chemical Property:

• Vapor Pressure: 1.27E-09mmHg at 25°C
• Boiling Point: 330.8°Cat760mmHg
• Flash Point: 153.8°C
• PSA: 57.70000
• Density: 1.47g/cm³
• LogP: 1.40820
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 203.11709544
• Heavy Atom Count: 15
• Complexity: 216

Purity/Quality:

97% ^*data from raw suppliers

6-PIPERIDINOPURINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)C2=NC=NC3=C2NC=N3

Technology Process of 6-(piperidin-1-yl)-9H-purine

There total 15 articles about 6-(piperidin-1-yl)-9H-purine 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: 94.0%

piperidine (110-89-4) + 6-chloropurine (87-42-3) → 6-(piperidin-1-yl)-9H-purine (1928-81-0)

Guidance literature:

at 80 ℃; for 0.0166667h; microwave irradiation;

DOI:10.1016/j.tet.2007.02.124

Reference yield: 92.7%

piperidine (110-89-4) + 6-chloro-7H-purine (87-42-3,111055-92-6) → 6-(piperidin-1-yl)-9H-purine (1928-81-0)

Guidance literature:

With triethylamine; In ethanol; at 80 ℃; for 6h;

DOI:10.1016/j.bmcl.2018.03.046

Reference yield: 91.0%

5-amino-4-(piperidinylamidino)imidazole + N,N-dimethylformamide diethyl diacetal (1188-33-6) → 6-(piperidin-1-yl)-9H-purine (1928-81-0)

Guidance literature:

In acetonitrile; at 20 ℃; for 3.5h;

DOI:10.1002/ejoc.200700416

upstream raw materials:

piperidine

(7⁽⁹⁾H-purin-6-ylsulfanyl)-acetic acid

2-chloro-6-piperidin-1-yl-7⁽⁹⁾H-purine

2-methylsulfanyl-6-piperidino-7⁽⁹⁾H-purine

Downstream raw materials:

Phosphoric acid (3aR,4R,6S,6aR)-2,2-dimethyl-6-(6-piperidin-1-yl-purin-9-yl)-tetrahydro-furo[3,4-d][1,3]dioxol-4-ylmethyl ester 2-fluoro-phenyl ester; compound with triethyl-amine

6-(piperidin-1-yl)-9-(β-D-ribofuranosyl)purine