N-(hexanoyl)ethanolamine
Basic information
- CAS
7726-06-9- Standard SMILES
CCCCCC(=O)NCCO- InChIKey
HVVJCLNYMSTOMR-UHFFFAOYSA-N- Molecular formula
- C8H17NO2
- Average molar mass
- 159.23 g/mol
- Monoisotopic mass
- 159.12592879
Overview
N-(hexanoyl)ethanolamine is an N-saturated fatty acyl-ethanolamine that is the ethanolamide of hexanoic acid. It is functionally related to a hexanoic acid.
Names & identifiers
- Preferred name
- N-(hexanoyl)ethanolamine
- IUPAC
- N-(2-hydroxyethyl)hexanamide
- English name
- N-Caproylethanolamine
- Molecular weight
- 0
Names & synonyms
n-(hexanoyl)ethanolamineN-hexanoyl ethanolamineCHEBI:85303RefChem:926952N-(2-Hydroxyethyl)hexanamideHexanamide, N-(2-hydroxyethyl)-7726-06-9N-CaproylethanolamineN-hexanoylethanolamineN-caproyl ethanolamineSCHEMBL5395768SCHEMBL7607354
Show more names
N-(2-Hydroxyethyl)hexanamide #DTXSID10339853HVVJCLNYMSTOMR-UHFFFAOYSA-NAKOS009129799CapronsA currencyuremonoA currencythanolamidQ27158471
Database identifiers
- CAS
7726-06-9- PubChem CID
- 559170
- DTXSID
DTXSID10339853- ChEBI
CHEBI:85303- Nikkaji
- J112.939B
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 104
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Chemistry & industry
Additional notes
DefinitionChEBI: N-(hexanoyl)ethanolamine is an N-saturated fatty acyl-ethanolamine that is the ethanolamide of hexanoic acid. It is functionally related to a hexanoic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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