Basic information
- CAS
646056-17-9- Standard SMILES
c1cc(N2CCCC23CCNC3)on1- InChIKey
ARJBWDBVOQMQBW-UHFFFAOYSA-N- Molecular formula
- C10H15N3O
- Average molar mass
- 193.25 g/mol
- Monoisotopic mass
- 193.12151211
Names & identifiers
- Preferred name
- 1,7-Diazaspiro[4.4]nonane, 1-(5-isoxazolyl)-
- IUPAC
- 5-(1,7-diazaspiro[4.4]nonan-1-yl)-1,2-oxazole
Names & synonyms
646056-17-95-(1,7-Diazaspiro[4.4]nonan-1-yl)isoxazole1,7-Diazaspiro[4.4]nonane, 1-(5-isoxazolyl)-SCHEMBL1556636DTXSID104698011-(1,2-OXAZOL-5-YL)-1,7-DIAZASPIRO[4.4]NONANE
Database identifiers
- CAS
646056-17-9- PubChem CID
- 11636983
- DTXSID
DTXSID10469801
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 41.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 223
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…