Basic information
- CAS
18677-98-0- Standard SMILES
C=CCC1(CC(C)NC(C)=O)C(=O)NC(=O)NC1=O- InChIKey
PVNGECPOGVAPDI-UHFFFAOYSA-N- Molecular formula
- C12H17N3O4
- Average molar mass
- 267.28 g/mol
- Monoisotopic mass
- 267.12190603
Names & identifiers
- Preferred name
- Acetamide, N-(2-(5-allyl-2,4,6-trioxohexahydro-5-pyrimidinyl)-1-methyl)-
- IUPAC
- N-[1-(2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-yl]acetamide
Names & synonyms
5-Allyl-5-(2'-acetamidopropyl)barbituric acid18677-98-0N-(2-(5-Allyl-2,4,6-trioxohexahydro-5-pyrimidinyl)-1-methyl)acetamideAcetamide, N-(2-(5-allyl-2,4,6-trioxohexahydro-5-pyrimidinyl)-1-methyl)-RefChem:315001DTXSID10940145N-{1-[4,6-Dihydroxy-2-oxo-5-(prop-2-en-1-yl)-2,5-dihydropyrimidin-5-yl]propan-2-yl}ethanimidic acid
Database identifiers
- CAS
18677-98-0- PubChem CID
- 205809
- DTXSID
DTXSID10940145
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 424
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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