Basic information
- CAS
415947-25-0- Standard SMILES
O=[N+]([O-])c1ccccc1-c1ccc(CN2CCCCC2)o1- InChIKey
DNRFBENUAYNADC-UHFFFAOYSA-N- Molecular formula
- C16H18N2O3
- Average molar mass
- 286.33 g/mol
- Monoisotopic mass
- 286.13174244
Names & identifiers
- Preferred name
- 1-[[5-(2-Nitrophenyl)furan-2-yl]methyl]piperidine
- IUPAC
- 1-[[5-(2-nitrophenyl)furan-2-yl]methyl]piperidine
Names & synonyms
415947-25-01-[[5-(2-Nitrophenyl)-2-furanyl]methyl]piperidine1-[[5-(2-nitrophenyl)furan-2-yl]methyl]piperidineCambridge id 54116641-{[5-(2-NITROPHENYL)FURAN-2-YL]METHYL}PIPERIDINEOprea1_162227SCHEMBL18862278DTXSID401232856AB00084355-011-{[5-(2-nitrophenyl)-2-furyl]methyl}piperidineSR-01000208199SR-01000208199-1
Database identifiers
- CAS
415947-25-0- PubChem CID
- 782018
- DTXSID
DTXSID401232856
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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