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Basic information
- Standard SMILES
CC(C)Cc1ccc2c(Cl)ccnc2n1- InChIKey
QQPPNVDESVDHOE-UHFFFAOYSA-N- Molecular formula
- C12H13ClN2
- Average molar mass
- 220.7 g/mol
- Monoisotopic mass
- 220.0767261
Names & identifiers
- Preferred name
- 1,8-Naphthyridine, 5-chloro-2-(2-methylpropyl)-
- IUPAC
- 5-chloro-2-(2-methylpropyl)-1,8-naphthyridine
Names & synonyms
943614-97-91,8-Naphthyridine, 5-chloro-2-(2-methylpropyl)-5-chloro-2-(2-methylpropyl)-1,8-naphthyridineSCHEMBL2968648QQPPNVDESVDHOE-UHFFFAOYSA-N5-chloro-2-isobutyl-1,8-naphthyridine5-Chloro-2-isobutyl-[1,8]naphthyridineDB-129308EN300-11175681,8-Naphthyridine,5-chloro-2-(2-methylpropyl)-
Database identifiers
- PubChem CID
- 68460720
Properties
Computed structural propertiesFilling in
- XLogP
- 3.7
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 208
Related reactions
6 records
Compound notes
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