N-(3-aminopropyl)-N-[5-[3-aminopropyl(hexadecanoyl)amino]-2,5-dimethylhexan-2-yl]hexadecanamide
Basic information
- CAS
79692-21-0- Standard SMILES
CCCCCCCCCCCCCCCC(=O)N(CCCN)C(C)(C)CCC(C)(C)N(CCCN)C(=O)CCCCCCCCCCCCCCC- InChIKey
FMWJPXQJIGTPAP-UHFFFAOYSA-N- Molecular formula
- C46H94N4O2
- Average molar mass
- 735.3 g/mol
- Monoisotopic mass
- 734.73767825
Names & identifiers
- Preferred name
- N-(3-aminopropyl)-N-[5-[3-aminopropyl(hexadecanoyl)amino]-2,5-dimethylhexan-2-yl]hexadecanamide
- IUPAC
- N-(3-aminopropyl)-N-[5-[3-aminopropyl(hexadecanoyl)amino]-2,5-dimethylhexan-2-yl]hexadecanamide
Names & synonyms
79692-21-0NSC239980N-(3-aminopropyl)-N-[5-[3-aminopropyl(hexadecanoyl)amino]-2,5-dimethylhexan-2-yl]hexadecanamideDTXSID10311179NSC-239980N,N'-(2,5-Dimethylhexane-2,5-diyl)bis[N-(3-aminopropyl)hexadecanamide]
Database identifiers
- CAS
79692-21-0- PubChem CID
- 315263
- DTXSID
DTXSID10311179
Properties
Computed structural properties
- XLogP
- 14.7
- Topological polar surface area
- 92.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 39
- Heavy atoms
- 52
- Formal charge
- 0
- Complexity
- 748
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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