3-(4-tert-butylphenyl)-N-(4-fluorophenyl)prop-2-enamide
Basic information
- CAS
5780-97-2- Standard SMILES
CC(C)(C)c1ccc(C=CC(=O)Nc2ccc(F)cc2)cc1- InChIKey
BCSPMKZEIWLDBW-UHFFFAOYSA-N- Molecular formula
- C19H20FNO
- Average molar mass
- 297.4 g/mol
- Monoisotopic mass
- 297.15289242
Names & identifiers
- Preferred name
- 3-(4-tert-butylphenyl)-N-(4-fluorophenyl)prop-2-enamide
- IUPAC
- 3-(4-tert-butylphenyl)-N-(4-fluorophenyl)prop-2-enamide
Names & synonyms
5780-97-23-(4-tert-butylphenyl)-N-(4-fluorophenyl)prop-2-enamideDTXSID30350469
Database identifiers
- CAS
5780-97-2- PubChem CID
- 680203
- DTXSID
DTXSID30350469
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 383
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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