3-{4-[(7-Methoxy-1,2,3,4-tetrahydro-naphthalen-2-yl)-propyl-amino]-butyl}-[1,3]oxazinan-2-one
Basic information
- Standard SMILES
CCCN(CCCCN1CCCOC1=O)C1CCc2ccc(OC)cc2C1- InChIKey
WMNUREXEXKDAAY-UHFFFAOYSA-N- Molecular formula
- C22H34N2O3
- Average molar mass
- 374.5 g/mol
- Monoisotopic mass
- 374.25694295
Names & identifiers
- Preferred name
- 3-{4-[(7-Methoxy-1,2,3,4-tetrahydro-naphthalen-2-yl)-propyl-amino]-butyl}-[1,3]oxazinan-2-one
- IUPAC
- 3-[4-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-propylamino]butyl]-1,3-oxazinan-2-one
Names & synonyms
SCHEMBL6593857WMNUREXEXKDAAY-UHFFFAOYSA-N3-{4-[(7-Methoxy-1,2,3,4-tetrahydro-naphthalen-2-yl)-propyl-amino]-butyl}-[1,3]oxazinan-2-one
Database identifiers
- PubChem CID
- 15922697
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 459
Related reactions
4 records
Compound notes
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