n-Propyl Cinnoline-4-carboxylate
Basic information
- Standard SMILES
CCCOC(=O)c1cnnc2ccccc12- InChIKey
MPFQXTKJRDNRGY-UHFFFAOYSA-N- Molecular formula
- C12H12N2O2
- Average molar mass
- 216.24 g/mol
- Monoisotopic mass
- 216.08987763
Names & identifiers
- Preferred name
- n-Propyl Cinnoline-4-carboxylate
- IUPAC
- propyl cinnoline-4-carboxylate
Names & synonyms
SCHEMBL10736752n-Propyl Cinnoline-4-carboxylateMPFQXTKJRDNRGY-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 20164604
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 245
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Related reactions
1 records
Compound notes
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