6-Methoxy-2-(alpha-(piperidinomethyl)benzyl)-3(2H)-pyridazinone
Basic information
- CAS
17072-90-1- Standard SMILES
COc1ccc(=O)n(C(CN2CCCCC2)c2ccccc2)n1- InChIKey
MKMBDXXDWPGLKW-UHFFFAOYSA-N- Molecular formula
- C18H23N3O2
- Average molar mass
- 313.4 g/mol
- Monoisotopic mass
- 313.17902698
Names & identifiers
- Preferred name
- 6-Methoxy-2-(alpha-(piperidinomethyl)benzyl)-3(2H)-pyridazinone
- IUPAC
- 6-methoxy-2-(1-phenyl-2-piperidin-1-ylethyl)pyridazin-3-one
Names & synonyms
BRN 08318656-Methoxy-2-(alpha-(piperidinomethyl)benzyl)-3(2H)-pyridazinone17072-90-13(2H)-Pyridazinone, 6-methoxy-2-(alpha-(piperidinomethyl)benzyl)-DTXSID009378276-Methoxy-2-[1-phenyl-2-(piperidin-1-yl)ethyl]pyridazin-3(2H)-one
Database identifiers
- CAS
17072-90-1- PubChem CID
- 204872
- DTXSID
DTXSID00937827
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 45.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 463
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Compound notes
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