Basic information
- Standard SMILES
O=C(NCCc1ccc2c(c1)OCO2)c1ccco1- InChIKey
WLHFPCJHKHNBDC-UHFFFAOYSA-N- Molecular formula
- C14H13NO4
- Average molar mass
- 259.26 g/mol
Names & identifiers
- Preferred name
- N-[2-(3,4-methylenedioxyphenyl)ethyl]furan-2-carboxamide
- IUPAC
- N-[2-(1,3-benzodioxol-5-yl)ethyl]furan-2-carboxamide
Names & synonyms
Oprea1_333611SCHEMBL9479824WLHFPCJHKHNBDC-UHFFFAOYSA-NAKOS008046237Z91143336N-[2-(3,4-methylenedioxyphenyl)-ethyl]furan-2-carboxamideN-[2-(3,4-methylenedioxyphenyl)ethyl]furan-2-carboxamide
Database identifiers
- PubChem CID
- 861822
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 60.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 323
Related reactions
3 records
Compound notes
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