6-Amino-5-(2-methylpropyl)-2-oxo-2,3-dihydropyrimidine-4-carboxylic acid
Basic information
- CAS
20865-56-9- Standard SMILES
CC(C)Cc1c(N)nc(=O)[nH]c1C(=O)O- InChIKey
JOFUFPLCAOFXIW-UHFFFAOYSA-N- Molecular formula
- C9H13N3O3
- Average molar mass
- 211.22 g/mol
- Monoisotopic mass
- 211.09569129
Names & identifiers
- Preferred name
- 6-Amino-5-(2-methylpropyl)-2-oxo-2,3-dihydropyrimidine-4-carboxylic acid
- IUPAC
- 4-amino-5-(2-methylpropyl)-2-oxo-1H-pyrimidine-6-carboxylic acid
Names & synonyms
20865-56-96-Amino-5-isobutyl-2-oxo-2,3-dihydropyrimidine-4-carboxylic acid6-amino-5-(2-methylpropyl)-2-oxo-2,3-dihydropyrimidine-4-carboxylic acidNSC154931SCHEMBL10773174DTXSID00302894NSC-154931DS-0058526-AMINO-5-(2-METHYLPROPYL)-2-OXO-3H-PYRIMIDINE-4-CARBOXYLIC ACID
Database identifiers
- CAS
20865-56-9- PubChem CID
- 290737
- DTXSID
DTXSID00302894
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 369
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…