Methyl 5-(3-quinolinyl)nicotinate
Basic information
- CAS
893735-07-4- Standard SMILES
COC(=O)c1cncc(-c2cnc3ccccc3c2)c1- InChIKey
ONJPHYLIEVACSU-UHFFFAOYSA-N- Molecular formula
- C16H12N2O2
- Average molar mass
- 264.28 g/mol
- Monoisotopic mass
- 264.08987763
Names & identifiers
- Preferred name
- Methyl 5-(3-quinolinyl)nicotinate
- IUPAC
- methyl 5-quinolin-3-ylpyridine-3-carboxylate
Names & synonyms
Methyl 5-(3-quinolinyl)nicotinate893735-07-4DTXSID501252049AKOS004116573Methyl 5-(3-quinolinyl)-3-pyridinecarboxylateMethyl 5-(quinolin-3-yl)pyridine-3-carboxylate
Database identifiers
- CAS
893735-07-4- PubChem CID
- 20099861
- DTXSID
DTXSID501252049
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 347
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Compound notes
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