Basic information
- Standard SMILES
COc1cc(N)nc(C)c1C#N- InChIKey
LHMAMOFOAIMOCD-UHFFFAOYSA-N- Molecular formula
- C8H9N3O
- Average molar mass
- 163.18 g/mol
- Monoisotopic mass
- 163.07456192
Names & identifiers
- Preferred name
- 6-Amino-4-methoxy-2-methylnicotinonitrile
- IUPAC
- 6-amino-4-methoxy-2-methylpyridine-3-carbonitrile
Names & synonyms
6-Amino-4-methoxy-2-methylnicotinonitrileSCHEMBL554373LHMAMOFOAIMOCD-UHFFFAOYSA-N6-amino-4-methoxy-2-methylpyridine-3-carbonitrile
Database identifiers
- PubChem CID
- 66723728
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 71.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 198
Related reactions
2 records
Compound notes
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