OCTADECANAMIDE, N-(2-AMINOETHYL)-N-(2-HYDROXYETHYL)-

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII FXX4ZV9D5Y
EPA CompTox DTXSID2059510

Structure

InChI Key YLWQPJKQVUOINR-UHFFFAOYSA-N
Smiles CCCCCCCCCCCCCCCCCC(=O)N(CCN)CCO
InChI
InChI=1S/C22H46N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(26)24(19-18-23)20-21-25/h25H,2-21,23H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H46N2O2
Molecular Weight 370.36
AlogP 5.03
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 20.0
Polar Surface Area 66.56
Heavy Atoms 26.0

Cross References

Resources Reference
CAS NUMBER 120-41-2
NORMAN SUSDAT
FDA SRS FXX4ZV9D5Y
PubChem 67119
ChemSpider 60467.0
CONTENTS