Basic information
- Standard SMILES
COCCn1nc(-c2ccc(OCC3CCCOC3)cc2)oc1=O- InChIKey
IGTMOYNXJJEOON-UHFFFAOYSA-N- Molecular formula
- C17H22N2O5
- Average molar mass
- 334.4 g/mol
- Monoisotopic mass
- 334.15287181
Names & identifiers
- Preferred name
- 5-[4-(tetrahydropyran-3-ylmethoxy)phenyl]-3-methoxyethyl-1,3,4-oxadiazol-2(3H)-one
- IUPAC
- 3-(2-methoxyethyl)-5-[4-(oxan-3-ylmethoxy)phenyl]-1,3,4-oxadiazol-2-one
Names & synonyms
SCHEMBL3504974IGTMOYNXJJEOON-UHFFFAOYSA-N5-[4-(tetrahydropyran-3-ylmethoxy)phenyl]-3-methoxyethyl-1,3,4-oxadiazol-2(3H)-one
Database identifiers
- PubChem CID
- 22402473
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 448
Related reactions
1 records
Compound notes
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