3-methyl-6-(4-methylanilino)-1H-pyrimidine-2,4-dione
Basic information
- CAS
76896-60-1- Standard SMILES
Cc1ccc(Nc2cc(=O)n(C)c(=O)[nH]2)cc1- InChIKey
IJQPBDRRFVKKDW-UHFFFAOYSA-N- Molecular formula
- C12H13N3O2
- Average molar mass
- 231.25 g/mol
- Monoisotopic mass
- 231.10077667
Names & identifiers
- Preferred name
- 3-methyl-6-(4-methylanilino)-1H-pyrimidine-2,4-dione
- IUPAC
- 3-methyl-6-(4-methylanilino)-1H-pyrimidine-2,4-dione
Names & synonyms
76896-60-1STK1772683-methyl-6-[(4-methylphenyl)amino]pyrimidine-2,4(1H,3H)-dione3-methyl-6-(4-methylanilino)-1H-pyrimidine-2,4-dioneOprea1_153969Oprea1_338656SCHEMBL5251305DTXSID70354628AKOS005410790ST50881028AG-690/12091564SR-01000218372
Show more names
SR-01000218372-13-methyl-6-(4-toluidino)-2,4(1H,3H)-pyrimidinedione3-Methyl-6-(4-methylanilino)pyrimidine-2,4(1H,3H)-dione3-methyl-6-[(4-methylphenyl)amino]-2,4(1H,3H)-pyrimidinedione3-methyl-6-[(4-methylphenyl)amino]-1,3-dihydropyrimidine-2,4-dione
Database identifiers
- CAS
76896-60-1- PubChem CID
- 777250
- DTXSID
DTXSID70354628
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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