Basic information
- Standard SMILES
CNCc1cc(-c2ccc(C)cc2)nn(CC(C)C)c1=O- InChIKey
LYGXOICTAHJGPO-UHFFFAOYSA-N- Molecular formula
- C17H23N3O
- Average molar mass
- 285.4 g/mol
Names & identifiers
- Preferred name
- 2-isobutyl-4-methylaminomethyl-6-(4-methylphenyl)-2H-pyridazin-3-one
- IUPAC
- 4-(methylaminomethyl)-6-(4-methylphenyl)-2-(2-methylpropyl)pyridazin-3-one
Names & synonyms
SCHEMBL1926041LYGXOICTAHJGPO-UHFFFAOYSA-N2-isobutyl-4-methylaminomethyl-6-(4-methylphenyl)-2H-pyridazin-3-one
Database identifiers
- PubChem CID
- 21991649
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 44.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 431
Related reactions
5 records
Compound notes
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