Basic information
- CAS
93094-25-8- Standard SMILES
CCCCC(=O)NCc1ccc(O)c(OC)c1- InChIKey
FIBVYIHLWQDQBL-UHFFFAOYSA-N- Molecular formula
- C13H19NO3
- Average molar mass
- 237.29 g/mol
- Monoisotopic mass
- 237.13649347
Names & identifiers
- Preferred name
- Pentanamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-
- IUPAC
- N-[(4-hydroxy-3-methoxyphenyl)methyl]pentanamide
Names & synonyms
BRN 3338262Pentanamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-N-((4-Hydroxy-3-methoxyphenyl)methyl)pentanamide93094-25-8N-[(4-hydroxy-3-methoxyphenyl)methyl]pentanamideN-(4-Hydroxy-3-methoxybenzyl)pentanamideCHEMBL419862SCHEMBL3266072DTXSID10239263N-[(4-hydroxy-3-methoxyphenyl)-methyl]-pentaylamide
Database identifiers
- CAS
93094-25-8- PubChem CID
- 3022073
- DTXSID
DTXSID10239263- ChEMBL
CHEMBL419862- Nikkaji
- J572.094J
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 233
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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