Cas no 181065-56-5 (2-Pyrimidinamine, N-(2-methylphenyl)-4-(3-pyridinyl)-)
181065-56-5 structure
Product Name:2-Pyrimidinamine, N-(2-methylphenyl)-4-(3-pyridinyl)-
CAS No:181065-56-5
MF:C16H14N4
MW:262.30916261673
CID:1377781
PubChem ID:10706608
Update Time:2025-04-20
2-Pyrimidinamine, N-(2-methylphenyl)-4-(3-pyridinyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyrimidinamine, N-(2-methylphenyl)-4-(3-pyridinyl)-
- SCHEMBL4373707
- 4-(Pyridin-3-yl)-N-(o-tolyl)pyrimidin-2-amine
- 181065-56-5
-
- Inchi： 1S/C16H14N4/c1-12-5-2-3-7-14(12)19-16-18-10-8-15(20-16)13-6-4-9-17-11-13/h2-11H,1H3,(H,18,19,20)
- InChI Key： UUKGNKFHXRQSEC-UHFFFAOYSA-N
- SMILES： N(C1N=CC=C(C2C=NC=CC=2)N=1)C1C=CC=CC=1C
Computed Properties
- Exact Mass: 262.12202
- Monoisotopic Mass: 262.121846464g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 296
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 50.7?2
Experimental Properties
- PSA: 50.7
2-Pyrimidinamine, N-(2-methylphenyl)-4-(3-pyridinyl)- Related Literature
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
181065-56-5 (2-Pyrimidinamine, N-(2-methylphenyl)-4-(3-pyridinyl)-) Related Products
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