Basic information
- Standard SMILES
CCn1nc(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)oc1=O- InChIKey
KMOAKYNKUNOKRP-UHFFFAOYSA-N- Molecular formula
- C15H18N4O4
- Average molar mass
- 318.33 g/mol
Names & identifiers
- Preferred name
- 3-Ethyl-5-[1-(4-nitro phenyl)-4-piperidyl]-2,3-dihydro-1,3,4-oxadiazol-2-one
- IUPAC
- 3-ethyl-5-[1-(4-nitrophenyl)piperidin-4-yl]-1,3,4-oxadiazol-2-one
Names & synonyms
SCHEMBL15059815KMOAKYNKUNOKRP-UHFFFAOYSA-N3-ethyl-5-[1-(4-nitro phenyl)-4-piperidyl]-2,3-dihydro-1,3,4-oxadiazol-2-one
Database identifiers
- PubChem CID
- 89651263
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 91 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 488
Related reactions
2 records
Compound notes
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