N-Methyl-3-pyridinamine, 1-oxide
Basic information
- CAS
54818-71-2- Standard SMILES
CNc1ccc[n+]([O-])c1- InChIKey
DMQAMMVBLOOPLE-UHFFFAOYSA-N- Molecular formula
- C6H8N2O
- Average molar mass
- 124.14 g/mol
- Monoisotopic mass
- 124.06366288
Names & identifiers
- Preferred name
- N-Methyl-3-pyridinamine, 1-oxide
- IUPAC
- N-methyl-1-oxidopyridin-1-ium-3-amine
Names & synonyms
N-Methyl-3-pyridinamine, 1-oxide54818-71-2DTXSID80203315RefChem:364466DTXCID80125806SCHEMBL147157073-Pyridinamine,N-methyl-,1-oxideN-Methyl-1-oxo-1lambda~5~-pyridin-3-amine
Database identifiers
- CAS
54818-71-2- PubChem CID
- 143201
- DTXSID
DTXSID80203315
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 37.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 87.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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