Basic information
- Standard SMILES
CN(C/C=C/C#CC(C)(C)C)Cc1cccc(OC/C=C/Cn2ccnc2)c1- InChIKey
IGBHKNGUIGHFQY-ZIRGRKGMSA-N- Molecular formula
- C24H31N3O
- Average molar mass
- 377.5 g/mol
Names & identifiers
- Preferred name
- (E,E)-N-methyl-N-(6,6-dimethyl-2-hepten-4-ynyl)-3-[4-(1-imidazolyl)-2-butenyloxy]benzylamine
- IUPAC
- (E)-N-[[3-[(E)-4-imidazol-1-ylbut-2-enoxy]phenyl]methyl]-N,6,6-trimethylhept-2-en-4-yn-1-amine
Names & synonyms
SCHEMBL9256373IGBHKNGUIGHFQY-ZIRGRKGMSA-N(E,E)-N-methyl-N-(6,6-dimethyl-2-hepten-4-ynyl)-3-[4-(1-imidazolyl)-2-butenyloxy]benzylamine
Database identifiers
- PubChem CID
- 19917065
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 30.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 563
Related reactions
1 records
Compound notes
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