Basic information
- Standard SMILES
CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)N1CCN(C)CC1- InChIKey
JSHFOXJVKVENQT-UHFFFAOYSA-N- Molecular formula
- C42H85N3O
- Average molar mass
- 648.1 g/mol
- Monoisotopic mass
- 647.66926434
Names & identifiers
- Preferred name
- 1-(N,N-Dioctadecylcarbamyl)-4-Methylpiperazine
- IUPAC
- 4-methyl-N,N-dioctadecylpiperazine-1-carboxamide
Names & synonyms
SCHEMBL10990821JSHFOXJVKVENQT-UHFFFAOYSA-N1-(N,N-Dioctadecylcarbamyl)-4-Methylpiperazine
Database identifiers
- PubChem CID
- 20432995
Properties
Computed structural properties
- XLogP
- 17.2
- Topological polar surface area
- 26.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 34
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 582
Related reactions
5 records
Compound notes
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