Basic information
- CAS
1129866-57-4- Standard SMILES
O=C1NC(=O)C2(CCCC2)N1c1ccccc1- InChIKey
XVJPHWFJBWTMGG-UHFFFAOYSA-N- Molecular formula
- C13H14N2O2
- Average molar mass
- 230.26 g/mol
- Monoisotopic mass
- 230.10552769
Names & identifiers
- Preferred name
- 1-Phenyl-1,3-diazaspiro[4.4]nonane-2,4-dione
- IUPAC
- 1-phenyl-1,3-diazaspiro[4.4]nonane-2,4-dione
Names & synonyms
1-phenyl-1,3-diazaspiro[4.4]nonane-2,4-dioneSCHEMBL2544529XVJPHWFJBWTMGG-UHFFFAOYSA-NDTXSID6012591671129866-57-4
Database identifiers
- CAS
1129866-57-4- PubChem CID
- 67446404
- DTXSID
DTXSID601259167
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 341
Related reactions
2 records
Compound notes
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