2-(Pyridin-4-yl)pyrimidin-4-amine

Base Information

• Chemical Name: 2-(Pyridin-4-yl)pyrimidin-4-amine
• CAS No.: 61310-29-0
• Molecular Formula: C9H8 N4
• Molecular Weight: 172.19
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID70384420
• Nikkaji Number: J578.944C
• Wikidata: Q82176553
• ChEMBL ID: CHEMBL354423
• Mol file: 61310-29-0.mol

Synonyms:61310-29-0;2-(4-pyridinyl)-4-pyrimidinamine;2-(pyridin-4-yl)pyrimidin-4-amine;2-pyridin-4-ylpyrimidin-4-amine;MFCD00119822;CHEMBL354423;SCHEMBL1018167;AMY5572;DTXSID70384420;2-(4-Pyridyl)pyrimidin-4-amine;AFNZWLWIUXHAIW-UHFFFAOYSA-N;4-Amino-2-(4-pyridyl)pyrimidine;4-amino-2-(4-pyridinyl)pyrimidine;4-amino-2-(4-pyridinyl)-pyrimidine;AKOS005070209;SB52586;AC-31860;CS-0213489;FT-0680294;2-(4-pyridinyl)-4-pyrimidinamine, AldrichCPR;EN300-154507;3R-0009;A868747;J-506587;Z960787216

Chemical Property of 2-(Pyridin-4-yl)pyrimidin-4-amine

Chemical Property:

• Vapor Pressure: 0.00397mmHg at 25°C
• Melting Point: 262-264°C
• Boiling Point: 279.6ºC at 760 mmHg
• Flash Point: 147.5°C
• PSA: 64.69000
• Density: 1.259g/cm3
• LogP: 1.70200
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 172.074896272
• Heavy Atom Count: 13
• Complexity: 156

Purity/Quality:

97% ^*data from raw suppliers

2-(4-Pyridinyl)-4-pyrimidinamine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38-22
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN=CC=C1C2=NC=CC(=N2)N

Technology Process of 2-(Pyridin-4-yl)pyrimidin-4-amine

There total 4 articles about 2-(Pyridin-4-yl)pyrimidin-4-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:

4-amidinopyridine hydrochloride (6345-27-3,42518-06-9,61875-64-7) + 2-Chloroacrylonitrile (920-37-6) → 2-(4-pyridinyl)-4-pyrimidinylamine (61310-29-0)

Guidance literature:

With sodium hydroxide; sodium methylate; In tetrahydrofuran; methanol;

Reference yield:

4-amidinopyridine hydrochloride (6345-27-3,42518-06-9,61875-64-7) → 2-(4-pyridinyl)-4-pyrimidinylamine (61310-29-0)

Guidance literature:

With sodium methylate; In tetrahydrofuran; methanol;

Reference yield:

2-chloropyrimidin-4-amine (7461-50-9) + 4-pyridylboronic acid (1692-15-5) → 2-(4-pyridinyl)-4-pyrimidinylamine (61310-29-0)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; sodium carbonate; In 1,2-dimethoxyethane; water; at 150 ℃; for 1h;

DOI:10.1016/j.bmcl.2013.08.025

upstream raw materials:

4-amidinopyridine hydrochloride

2-Chloroacrylonitrile

2-chloropyrimidin-4-amine

4-pyridylboronic acid

Downstream raw materials:

1-tert-butyl-3-(2-pyridin-4-yl-pyrimidin-4-yl)-urea

1-cyclohexyl-3-(2-pyridin-4-yl-pyrimidin-4-yl)-urea

1-(3,4-dichlorophenyl)-3-(2-(pyridin-4-yl)pyrimidin-4-yl)urea