Basic information
- CAS
547770-16-1- Standard SMILES
CCC(=O)NCC(O)c1ccc(F)c(OC)c1- InChIKey
MMIOYFJMSWJSJT-UHFFFAOYSA-N- Molecular formula
- C12H16FNO3
- Average molar mass
- 241.26 g/mol
- Monoisotopic mass
- 241.11142153
Names & identifiers
- Preferred name
- N-[2-(4-Fluoro-3-methoxyphenyl)-2-hydroxyethyl]propionamide
- IUPAC
- N-[2-(4-fluoro-3-methoxyphenyl)-2-hydroxyethyl]propanamide
Names & synonyms
N-[2-(4-Fluoro-3-methoxyphenyl)-2-hydroxyethyl]propionamideN-[2-(4-Fluoro-3-methoxyphenyl]-2-hydroxyethyl]propionamideSCHEMBL2077445MMIOYFJMSWJSJT-UHFFFAOYSA-NDTXSID701193281547770-16-1N-[2-(4-fluoro-3-methoxyphenyl)-2-hydroxyethyl]propanamideN-[2-(4-Fluoro-3-methoxyphenyl)-2-hydroxyethyl]-propionamide
Database identifiers
- CAS
547770-16-1- PubChem CID
- 59645261
- DTXSID
DTXSID701193281
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 250
Related reactions
4 records
Compound notes
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