Basic information
- Standard SMILES
CCC(C)C(NC(=O)c1cc(=O)[nH]c(=O)[nH]1)C(=O)O- InChIKey
WLPGJPLUYUOGFM-UHFFFAOYSA-N- Molecular formula
- C11H15N3O5
- Average molar mass
- 269.25 g/mol
- Monoisotopic mass
- 269.10117059
Names & identifiers
- Preferred name
- 2-(2,6-Dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxamido)-3-methylpentanoic acid
- IUPAC
- 2-[(2,4-dioxo-1H-pyrimidine-6-carbonyl)amino]-3-methylpentanoic acid
Names & synonyms
SCHEMBL3433136WLPGJPLUYUOGFM-UHFFFAOYSA-NAKOS0091628042-(2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxamido)-3-methylpentanoic acid
Database identifiers
- PubChem CID
- 24693148
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 457
Related reactions
2 records
Compound notes
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