Basic information
- CAS
146967-52-4- Standard SMILES
Cc1cc2cccnc2n(CCC(C)C)c1=O- InChIKey
LYEKNWXOMLLNEI-UHFFFAOYSA-N- Molecular formula
- C14H18N2O
- Average molar mass
- 230.31 g/mol
- Monoisotopic mass
- 230.1419132
Names & identifiers
- Preferred name
- 1,8-Naphthyridin-2(1H)-one, 3-methyl-1-(3-methylbutyl)-
- IUPAC
- 3-methyl-1-(3-methylbutyl)-1,8-naphthyridin-2-one
Names & synonyms
146967-52-43-Methyl-1-(3-methylbutyl)-1,8-naphthyridin-2(1H)-one1,8-Naphthyridin-2(1H)-one, 3-methyl-1-(3-methylbutyl)-DTXSID30163551RefChem:221815DTXCID60860421-Isopentyl-3-methyl-1,8-naphthyridin-2(1H)-oneSCHEMBL8324866
Database identifiers
- CAS
146967-52-4- PubChem CID
- 3073166
- DTXSID
DTXSID30163551- Nikkaji
- J577.260E
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 33.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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