2-ethyl-N-[(4-fluorophenyl)methyl]hexanamide
Basic information
- CAS
543713-04-8- Standard SMILES
CCCCC(CC)C(=O)NCc1ccc(F)cc1- InChIKey
VUXZNWFEOJKQGV-UHFFFAOYSA-N- Molecular formula
- C15H22FNO
- Average molar mass
- 251.34 g/mol
- Monoisotopic mass
- 251.16854249
Names & identifiers
- Preferred name
- 2-ethyl-N-[(4-fluorophenyl)methyl]hexanamide
- IUPAC
- 2-ethyl-N-[(4-fluorophenyl)methyl]hexanamide
Names & synonyms
2-ethyl-N-[(4-fluorophenyl)methyl]hexanamide543713-04-82-ethyl-N-(4-fluorobenzyl)hexanamideMLS000680682CHEMBL1708808DTXSID101256168HMS2551O24STK435381AKOS003283159AKOS022165233SMR000272273ST50924769
Database identifiers
- CAS
543713-04-8- PubChem CID
- 2932286
- DTXSID
DTXSID101256168- ChEMBL
CHEMBL1708808
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 237
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Compound notes
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