Basic information
- CAS
194038-29-4- Standard SMILES
CCCCCCCCCCCCCCCC(=O)NC(CN1CCOCC1)C(O)c1ccccc1- InChIKey
OFBANDBMHLEMFA-UHFFFAOYSA-N- Molecular formula
- C29H50N2O3
- Average molar mass
- 474.7 g/mol
- Monoisotopic mass
- 474.38214346
Overview
N-[1-hydroxy-3-(morpholin-4-yl)-1-phenylpropan-2-yl]hexadecanamide is a fatty amide resulting from the formal condensation of palmitic acid with the primary amino group of 2-amino-3-(morpholin-4-yl)-1-phenylpropan-1-ol. It is a member of benzyl alcohols, a fatty amide, a secondary alcohol, a member of morpholines and a tertiary amino compound.
Names & identifiers
- Preferred name
- 1-Phenyl-2-palmitoylamino-3-morpholino-1-propanol
- IUPAC
- N-(1-hydroxy-3-morpholin-4-yl-1-phenylpropan-2-yl)hexadecanamide
Names & synonyms
1-phenyl-2-palmitoylamino-3-morpholino-1-propanol1-phenyl-2-hexadecanoylamino-3-morpholino-1-propanolRefChem:9078031-PPMPPPMP-1N-[1-hydroxy-3-(morpholin-4-yl)-1-phenylpropan-2-yl]hexadecanamide194038-29-4CHEBI:75125SCHEMBL840939CHEMBL1241757DTXSID90274394N-(1-hydroxy-3-morpholin-4-yl-1-phenylpropan-2-yl)hexadecanamide
Show more names
Q27145139N-[1-hydroxy-3-(morpholin-4-yl)-1-phenylpropan-2-yl]palmitamide
Database identifiers
- CAS
194038-29-4- PubChem CID
- 3130
- DTXSID
DTXSID90274394- ChEMBL
CHEMBL1241757- ChEBI
CHEBI:75125- Nikkaji
- J759.907B
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 19
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 490
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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