1-Isobutyl-5-methylpyrimidine-2,4(1h,3h)-dione
Basic information
- CAS
7153-02-8- Standard SMILES
Cc1cn(CC(C)C)c(=O)[nH]c1=O- InChIKey
MCUUAPWMJRNOJB-UHFFFAOYSA-N- Molecular formula
- C9H14N2O2
- Average molar mass
- 182.22 g/mol
- Monoisotopic mass
- 182.10552769
Names & identifiers
- Preferred name
- 1-Isobutyl-5-methylpyrimidine-2,4(1h,3h)-dione
- IUPAC
- 5-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione
Names & synonyms
1-isobutyl-5-methylpyrimidine-2,4(1h,3h)-dione7153-02-8DTXSID00286488RefChem:231122DTXCID002376375-methyl-1-(2-methylpropyl)pyrimidine-2,4(1H,3H)-dioneNSC46088ChemDiv2_002422SCHEMBL12862593HMS1375O02NSC-46088STK675044
Show more names
AKOS005593626ST0777981-isobutyl-5-methyl-2,4(1H,3H)-pyrimidinedioneAG-205/12549051SR-01000523159SR-01000523159-15-methyl-1-(2-methylpropyl)-1,3-dihydropyrimidine-2,4-dione
Database identifiers
- CAS
7153-02-8- PubChem CID
- 240106
- DTXSID
DTXSID00286488
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 269
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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