Cas no 911461-30-8 (4-methoxypyrimidine-5-carboxamide)
911461-30-8 structure
Product Name:4-methoxypyrimidine-5-carboxamide
CAS No:911461-30-8
MF:C6H7N3O2
MW:153.138680696487
CID:996029
PubChem ID:53426664
Update Time:2025-04-20
4-methoxypyrimidine-5-carboxamide Chemical and Physical Properties
Names and Identifiers
-
- 4-methoxypyrimidine-5-carboxamide
- 5- Pyrimidinecarboxamide, 4-methoxy-
- 4-Methoxy-5-pyrimidinecarboxamide
- 911461-30-8
- AMY15854
- DTXSID50699307
-
- Inchi： 1S/C6H7N3O2/c1-11-6-4(5(7)10)2-8-3-9-6/h2-3H,1H3,(H2,7,10)
- InChI Key： YEVRPHYQWOHHDR-UHFFFAOYSA-N
- SMILES： O(C)C1C(C(N)=O)=CN=CN=1
Computed Properties
- Exact Mass: 153.05400
- Monoisotopic Mass: 153.054
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 151
- 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
- Topological Polar Surface Area: 78.1A^2
- XLogP3: -0.6
Experimental Properties
- PSA: 78.10000
- LogP: 0.28440
4-methoxypyrimidine-5-carboxamide Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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