N-(1,3-benzodioxol-5-yl)-2-(2-methoxyphenoxy)acetamide
Basic information
- CAS
351899-16-6- Standard SMILES
COc1ccccc1OCC(=O)Nc1ccc2c(c1)OCO2- InChIKey
ROSBMALMBFUNLI-UHFFFAOYSA-N- Molecular formula
- C16H15NO5
- Average molar mass
- 301.29 g/mol
- Monoisotopic mass
- 301.09502258
Names & identifiers
- Preferred name
- N-(1,3-benzodioxol-5-yl)-2-(2-methoxyphenoxy)acetamide
- IUPAC
- N-(1,3-benzodioxol-5-yl)-2-(2-methoxyphenoxy)acetamide
Names & synonyms
N-(1,3-benzodioxol-5-yl)-2-(2-methoxyphenoxy)acetamideCBMicro_000351Cambridge id 5685257Oprea1_596379MLS001217295CHEMBL1491495N-Benzo[1,3]dioxol-5-yl-2-(2-methoxy-phenoxy)-acetamideDTXSID801326358HMS2902D21SMSF0006973STL139288AKOS000381637
Show more names
CB01541351899-16-6SMR000611526BIM-0000511.P001ST50268232AG-670/11899242Z19754061N-1,3-benzodioxol-5-yl-2-(2-methoxyphenoxy)acetamide
Database identifiers
- CAS
351899-16-6- PubChem CID
- 1145346
- DTXSID
DTXSID801326358- ChEMBL
CHEMBL1491495
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 378
Experimental & physicochemical properties
Solubility40.9 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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