Basic information
- Standard SMILES
CCN(CC=CC#CC(C)(C)OC)Cc1ccc(C=O)o1- InChIKey
PTGRBCIJEXXTNB-UHFFFAOYSA-N- Molecular formula
- C17H23NO3
- Average molar mass
- 289.4 g/mol
- Monoisotopic mass
- 289.1677936
Names & identifiers
- Preferred name
- 5-[[Ethyl-(6-methoxy-6-methylhept-2-en-4-ynyl)amino]methyl]furan-2-carbaldehyde
- IUPAC
- 5-[[ethyl-(6-methoxy-6-methylhept-2-en-4-ynyl)amino]methyl]furan-2-carbaldehyde
Names & synonyms
SCHEMBL9247557
Database identifiers
- PubChem CID
- 73668007
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 42.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 416
Related reactions
1 records
Compound notes
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