N-(2-((3-Cyano-6-methylquinolin-2-yl)amino)ethyl)-3-fluorobenzamide
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Basic information
- CAS
606105-46-8- Standard SMILES
Cc1ccc2nc(NCCNC(=O)c3cccc(F)c3)c(C#N)cc2c1- InChIKey
RHXPNCWNSJPBBH-UHFFFAOYSA-N- Molecular formula
- C20H17FN4O
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.13863934
Names & identifiers
- Preferred name
- N-(2-((3-Cyano-6-methylquinolin-2-yl)amino)ethyl)-3-fluorobenzamide
- IUPAC
- N-[2-[(3-cyano-6-methylquinolin-2-yl)amino]ethyl]-3-fluorobenzamide
- English name
- Benzamide, N-[2-[(3-cyano-6-methyl-2-quinolinyl)amino]ethyl]-3-fluoro- (9CI)
- Molecular formula
- C20H17FN4O
- Molecular weight
- 348.3735832
Names & synonyms
606105-46-8N-{2-[(3-Cyano-6-methyl-2-quinolinyl)amino]ethyl}-3-fluorobenzamideN-(2-((3-Cyano-6-methylquinolin-2-yl)amino)ethyl)-3-fluorobenzamideN-[2-[(3-cyano-6-methylquinolin-2-yl)amino]ethyl]-3-fluorobenzamideN-{2-[(3-Cyano-6-methylquinolin-2-yl)amino]ethyl}-3-fluorobenzamideDTXSID70390440SR-01000344266SR-01000344266-1Benzamide, N-[2-[(3-cyano-6-methyl-2-quinolinyl)amino]ethyl]-3-fluoro- (9CI)
Database identifiers
- CAS
606105-46-8- PubChem CID
- 3217029
- DTXSID
DTXSID70390440
Properties
Computed structural propertiesFilling in
- XLogP
- 4.2
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 533
Related reactions
0 records
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Compound notes
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