Basic information
- CAS
830341-31-6- Standard SMILES
Cc1cc(C(=O)Nc2cnccn2)no1- InChIKey
UQNJDBHOJZMJFS-UHFFFAOYSA-N- Molecular formula
- C9H8N4O2
- Average molar mass
- 204.19 g/mol
- Monoisotopic mass
- 204.06472551
Names & identifiers
- Preferred name
- 5-methyl-N-pyrazin-2-yl-1,2-oxazole-3-carboxamide
- IUPAC
- 5-methyl-N-pyrazin-2-yl-1,2-oxazole-3-carboxamide
- English name
- 5-Methyl-N-2-pyrazinyl-3-isoxazolecarboxamide
- Molecular formula
- C9H8N4O2
- Molecular weight
- 204.19
Names & synonyms
830341-31-65-methyl-N-pyrazin-2-yl-1,2-oxazole-3-carboxamide5-Methyl-N-(pyrazin-2-yl)isoxazole-3-carboxamide5-methyl-N~3~-(2-pyrazinyl)-3-isoxazolecarboxamide5-methyl-N-(pyrazin-2-yl)-1,2-oxazole-3-carboxamideST50833382SCHEMBL17531863DTXSID30388025STK467372AKOS003374106(5-methylisoxazol-3-yl)-N-pyrazin-2-ylcarboxamide5-Methyl-npyrazin-2-yl-3-isoxazolecarboxamide
Show more names
3-Isoxazolecarboxamide, 5-methyl-N-2-pyrazinyl-
Database identifiers
- CAS
830341-31-6- PubChem CID
- 2971007
- DTXSID
DTXSID30388025
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 236
Physicochemical properties
- Boiling point
- 315.2 · 315.2±42.0 °C(Predicted)
- Density
- 1.388 · 1.388±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
- pka
- 10.39 · 10.39±0.70(Predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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