N-[2-(2-fluorophenyl)ethyl]quinoline-8-carboxamide
Basic information
- CAS
879153-35-2- Standard SMILES
O=C(NCCc1ccccc1F)c1cccc2cccnc12- InChIKey
GVUUQUYUDXJVQD-UHFFFAOYSA-N- Molecular formula
- C18H15FN2O
- Average molar mass
- 294.3 g/mol
- Monoisotopic mass
- 294.11684127
Names & identifiers
- Preferred name
- N-[2-(2-fluorophenyl)ethyl]quinoline-8-carboxamide
- IUPAC
- N-[2-(2-fluorophenyl)ethyl]quinoline-8-carboxamide
Names & synonyms
879153-35-2N-[2-(2-fluorophenyl)ethyl]quinoline-8-carboxamideN-(2-Fluorophenethyl)quinoline-8-carboxamideN-[2-(2-Fluorophenyl)ethyl]-8-quinolinecarboxamideMLS001176387CHEMBL1335779DTXSID901327361HMS2890P16AKOS034490987CID 9508170SMR000592572Z62873497
Database identifiers
- CAS
879153-35-2- PubChem CID
- 9508170
- DTXSID
DTXSID901327361- ChEMBL
CHEMBL1335779
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 376
Experimental & physicochemical properties
Solubility31.4 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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