2,4-Diazaspiro(5.5)undecane-1,3,5-trione, 7-propyl-
Basic information
- CAS
67196-34-3- Standard SMILES
CCCC1CCCCC12C(=O)NC(=O)NC2=O- InChIKey
BCQVVBFPFXLDSM-UHFFFAOYSA-N- Molecular formula
- C12H18N2O3
- Average molar mass
- 238.28 g/mol
- Monoisotopic mass
- 238.13174244
Names & identifiers
- Preferred name
- 2,4-Diazaspiro(5.5)undecane-1,3,5-trione, 7-propyl-
- IUPAC
- 11-propyl-2,4-diazaspiro[5.5]undecane-1,3,5-trione
- English name
- 7-Propyl-2,4-diazaspiro[5.5]undecane-1,3,5-trione
- Molecular formula
- C12H18N2O3
- Molecular weight
- 238.28
Names & synonyms
67196-34-32,4-Diazaspiro(5.5)undecane-1,3,5-trione, 7-propyl-2,4-Diazaspiro[5.5]undecane-1,3,5-trione, 7-propyl-RefChem:10597007-propyl-2,4-diazaspiro[5.5]undecane-1,3,5-trioneMLS0027067317-Propyl-2,4-diazaspiro(5.5)undecane-1,3,5-trioneBRN 0233793NSC1174594-24-00-02023 (Beilstein Handbook Reference)2,3,5-trione, 7-propyl-CHEMBL2143117
Show more names
NSC 117459NSC-117459SMR001574131
Database identifiers
- CAS
67196-34-3- PubChem CID
- 98386
- ChEMBL
CHEMBL2143117- Nikkaji
- J68.508I
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 345
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Compound notes
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