5-Cyclopentyl-5-(2-methylprop-2-enyl)-1,3-diazinane-2,4,6-trione
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Basic information
- CAS
66940-73-6- Standard SMILES
C=C(C)CC1(C2CCCC2)C(=O)NC(=O)NC1=O- InChIKey
WROTVYWUIATKTR-UHFFFAOYSA-N- Molecular formula
- C13H18N2O3
- Average molar mass
- 250.29 g/mol
- Monoisotopic mass
- 250.13174244
Names & identifiers
- Preferred name
- 5-Cyclopentyl-5-(2-methylprop-2-enyl)-1,3-diazinane-2,4,6-trione
- IUPAC
- 5-cyclopentyl-5-(2-methylprop-2-enyl)-1,3-diazinane-2,4,6-trione
- English name
- 5-Cyclopentyl-5-(2-methyl-2-propenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular formula
- C13H18N2O3
- Molecular weight
- 0
Names & synonyms
66940-73-65-cyclopentyl-5-(2-methylprop-2-enyl)-1,3-diazinane-2,4,6-trioneDTXSID502755245-cyclopentyl-5-(2-methylprop-2-en-1-yl)-1,3-diazinane-2,4,6-trione5-cyclopentyl-5-methallyl-barbituric acid5-Cyclopentyl-5-(2-methylallyl)barbituric acid5-Cyclopentyl-5-(2-methyl-2-propenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Database identifiers
- CAS
66940-73-6- PubChem CID
- 48421
- DTXSID
DTXSID50275524- Nikkaji
- J105.442B
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 402
Related reactions
0 records
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Compound notes
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