Basic information
- Standard SMILES
COC(=O)C(C)(Nc1noc(=O)c2ccccc12)C(C)C- InChIKey
YUWBTKLLHFKCSI-UHFFFAOYSA-N- Molecular formula
- C15H18N2O4
- Average molar mass
- 290.31 g/mol
- Monoisotopic mass
- 290.12665706
Names & identifiers
- Preferred name
- Methyl 2,3-dimethyl-2-[(1-oxo-2,3-benzoxazin-4-yl)amino]butyrate
- IUPAC
- methyl 2,3-dimethyl-2-[(1-oxo-2,3-benzoxazin-4-yl)amino]butanoate
Names & synonyms
SCHEMBL9200353YUWBTKLLHFKCSI-UHFFFAOYSA-Nmethyl 2,3-dimethyl-2-[(1-oxo-2,3-benzoxazin-4-yl)amino]butyrate
Database identifiers
- PubChem CID
- 15029344
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 77 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 461
Related reactions
5 records
Compound notes
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