Cas no 104893-53-0 (2-Pyrazinecarboxamide,3-ethyl-)
104893-53-0 structure
Product Name:2-Pyrazinecarboxamide,3-ethyl-
CAS No:104893-53-0
MF:C7H9N3O
MW:151.165860891342
CID:126526
PubChem ID:13883471
Update Time:2025-04-18
2-Pyrazinecarboxamide,3-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyrazinecarboxamide,3-ethyl-
- Pyrazinecarboxamide,3-ethyl- (9CI)
- 104893-53-0
- Pyrazinecarboxamide,3-ethyl-(9ci)
- SCHEMBL3461163
- 3-ethylpyrazine-2-carboxamide
-
- Inchi： 1S/C7H9N3O/c1-2-5-6(7(8)11)10-4-3-9-5/h3-4H,2H2,1H3,(H2,8,11)
- InChI Key： RMPQHYUEGIDFHG-UHFFFAOYSA-N
- SMILES： O=C(C1C(CC)=NC=CN=1)N
Computed Properties
- Exact Mass: 151.07467
- Monoisotopic Mass: 151.074561919g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 149
- 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: -0.2
- Topological Polar Surface Area: 68.9?2
Experimental Properties
- PSA: 68.87
2-Pyrazinecarboxamide,3-ethyl- Related Literature
-
Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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