Basic information
- Standard SMILES
COc1cc2c(cc1C(C)C)N(C)CCO2- InChIKey
CHNRRSFDBNXDOR-UHFFFAOYSA-N- Molecular formula
- C13H19NO2
- Average molar mass
- 221.29 g/mol
- Monoisotopic mass
- 221.14157885
Names & identifiers
- Preferred name
- 6-Isopropyl-7-methoxy-4-methyl-3,4-dihydro-2H-benzo[1,4]oxazine
- IUPAC
- 7-methoxy-4-methyl-6-propan-2-yl-2,3-dihydro-1,4-benzoxazine
Names & synonyms
SCHEMBL1494287CHNRRSFDBNXDOR-UHFFFAOYSA-NDB-2039516-Isopropyl-7-methoxy-4-methyl-3,4-dihydro-2H-benzo[1,4]oxazine3,4-Dihydro-6-isopropyl-7-methoxy-4-methyl-2h-benzo[b][1,4]oxazine865305-81-3
Database identifiers
- PubChem CID
- 59598564
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 232
Related reactions
5 records
Compound notes
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