Basic information
- CAS
832102-89-3- Standard SMILES
O=[N+]([O-])c1ccc2nc(CN3CCC(c4ccc(F)cc4)CC3)ccc2c1- InChIKey
AALAFRCTXXQRKK-UHFFFAOYSA-N- Molecular formula
- C21H20FN3O2
- Average molar mass
- 365.4 g/mol
- Monoisotopic mass
- 365.15395505
Names & identifiers
- Preferred name
- Quinoline, 2-[[4-(4-fluorophenyl)-1-piperidinyl]methyl]-6-nitro-
- IUPAC
- 2-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]-6-nitroquinoline
Names & synonyms
832102-89-3Quinoline, 2-[[4-(4-fluorophenyl)-1-piperidinyl]methyl]-6-nitro-SCHEMBL6233604DTXSID404754302-{[4-(4-FLUOROPHENYL)PIPERIDIN-1-YL]METHYL}-6-NITROQUINOLINE
Database identifiers
- CAS
832102-89-3- PubChem CID
- 11994271
- DTXSID
DTXSID40475430
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 62 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 498
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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