Basic information
- Standard SMILES
O=C1C=C(N(CCF)Cc2ccc(Cl)nc2)CO1- InChIKey
SNNQRPYPSAJQKV-UHFFFAOYSA-N- Molecular formula
- C12H12ClFN2O2
- Average molar mass
- 270.69 g/mol
Names & identifiers
- Preferred name
- 4-[[(6-chloropyridin-3-yl)methyl](2-fluoroethyl)amino]furan-2(5H)-one
- IUPAC
- 3-[(6-chloro-3-pyridinyl)methyl-(2-fluoroethyl)amino]-2H-furan-5-one
Names & synonyms
SCHEMBL120449SNNQRPYPSAJQKV-UHFFFAOYSA-N4-[[(6-chloropyridin-3-yl)methyl](2-fluoroethyl)amino]furan-2(5H)-one4-{[(6-chloropyrid-3-yl)methyl](2-fluoroethyl)amino}furan-2(5h)-one
Database identifiers
- PubChem CID
- 25227411
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 338
Related reactions
7 records
Linked notes
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