2-(1,3-benzodioxol-5-yloxy)-N-cyclohexyl-N-phenylacetamide
Basic information
- CAS
878942-21-3- Standard SMILES
O=C(COc1ccc2c(c1)OCO2)N(c1ccccc1)C1CCCCC1- InChIKey
RIOCHAQVBRUUTL-UHFFFAOYSA-N- Molecular formula
- C21H23NO4
- Average molar mass
- 353.4 g/mol
- Monoisotopic mass
- 353.16270821
Names & identifiers
- Preferred name
- 2-(1,3-benzodioxol-5-yloxy)-N-cyclohexyl-N-phenylacetamide
- IUPAC
- 2-(1,3-benzodioxol-5-yloxy)-N-cyclohexyl-N-phenylacetamide
Names & synonyms
2-(1,3-benzodioxol-5-yloxy)-N-cyclohexyl-N-phenylacetamide878942-21-3TT72EC8HHRCHEMBL5771994SCHEMBL10270943BDBM435222DTXSID801357428AKOS033703956US10584134, Example 3-44Z19742383Acetamide, 2-(1,3-benzodioxol-5-yloxy)-N-cyclohexyl-N-phenyl-
Database identifiers
- CAS
878942-21-3- PubChem CID
- 9505622
- DTXSID
DTXSID801357428- ChEMBL
CHEMBL5771994- UNII
- TT72EC8HHR
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 459
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Compound notes
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