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Basic information
- Standard SMILES
COCCCN1C(=O)C(C)(C)Oc2ccc(NC3CC3)cc21- InChIKey
DFENHJNHGRTIIG-UHFFFAOYSA-N- Molecular formula
- C17H24N2O3
- Average molar mass
- 304.4 g/mol
Names & identifiers
- Preferred name
- 6-Cyclopropylamino-4-(3-methoxy-propyl)-2,2-dimethyl-4H-benzo[1,4]oxazin-3-one
- IUPAC
- 6-(cyclopropylamino)-4-(3-methoxypropyl)-2,2-dimethyl-1,4-benzoxazin-3-one
Names & synonyms
SCHEMBL90462DFENHJNHGRTIIG-UHFFFAOYSA-N6-Cyclopropylamino-4-(3-methoxy-propyl)-2,2-dimethyl-4H-benzo[1,4]oxazin-3-one
Database identifiers
- PubChem CID
- 57790355
Properties
Computed structural propertiesFilling in
- XLogP
- 2.4
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 409
Related reactions
2 records
Compound notes
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