Basic information
- Standard SMILES
O=C(O)NC1CCCCN(C(=O)NCC(F)(F)F)C1=O- InChIKey
JIYYNNQOJRHJEI-UHFFFAOYSA-N- Molecular formula
- C10H14F3N3O4
- Average molar mass
- 297.23 g/mol
- Monoisotopic mass
- 297.09364042
Names & identifiers
- IUPAC
- [2-oxo-1-(2,2,2-trifluoroethylcarbamoyl)azepan-3-yl]carbamic acid
Database identifiers
- PubChem CID
- 21101882
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 400
Related reactions
1 records
Compound notes
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