6-Ethyl-2H-benzo[b][1,4]oxazin-3(4H)-one
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Basic information
- Standard SMILES
CCc1ccc2c(c1)NC(=O)CO2- InChIKey
TWYRMESOIJMLJN-UHFFFAOYSA-N- Molecular formula
- C10H11NO2
- Average molar mass
- 177.2 g/mol
Names & identifiers
- Preferred name
- 6-Ethyl-2H-benzo[b][1,4]oxazin-3(4H)-one
- IUPAC
- 6-ethyl-4H-1,4-benzoxazin-3-one
Names & synonyms
CHEMBL24079926-Ethyl-2H-benzo[b][1,4]oxazin-3(4H)-oneSCHEMBL532134SCHEMBL4421255TWYRMESOIJMLJN-UHFFFAOYSA-NBDBM50438254AKOS005146793
Database identifiers
- PubChem CID
- 50878733
- ChEMBL
CHEMBL2407992
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 205
Related reactions
1 records
Compound notes
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