(Z)-N-(2-hydroxyethyl)icos-11-enamide

C22H43NO2 — CID 5283452

IUPAC(Z)-N-(2-hydroxyethyl)icos-11-enamide
SMILESCCCCCCCC/C=C\CCCCCCCCCC(=O)NCCO
InChIInChI=1S/C22H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h9-10,24H,2-8,11-21H2,1H3,(H,23,25)/b10-9-
InChIKeyYDKRGMXLBRWZJR-KTKRTIGZSA-N
MW353.59 g/mol
LogP5.91
Rot. Bonds19

About (Z)-N-(2-hydroxyethyl)icos-11-enamide

(Z)-N-(2-hydroxyethyl)icos-11-enamide (PubChem CID 5283452) has the molecular formula C22H43NO2 and a molecular weight of 353.59 g/mol. Its IUPAC name is (Z)-N-(2-hydroxyethyl)icos-11-enamide.

Molecular Properties

Compound Name(Z)-N-(2-hydroxyethyl)icos-11-enamide
PubChem CID5283452
Molecular FormulaC22H43NO2
Molecular Weight353.59 g/mol
Exact Mass353.33
IUPAC Name(Z)-N-(2-hydroxyethyl)icos-11-enamide
SMILESCCCCCCCC/C=C\CCCCCCCCCC(=O)NCCO
InChIInChI=1S/C22H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h9-10,24H,2-8,11-21H2,1H3,(H,23,25)/b10-9-
InChIKeyYDKRGMXLBRWZJR-KTKRTIGZSA-N
XLogP5.91
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds19
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.59
LogP ≤ 55.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Oleoylethanolamide
CID 5283454
N-Linoleoylethanolamine
CID 5283446
Anandamide
CID 5281969
C16-Ceramide
CID 5283564
C24-Ceramide
CID 5283571
N-Oleoylglycine
CID 6436908
Oleic acid diethanolamide
CID 5371728
N-(2-Hydroxyethyl)-7Z,10Z,13Z,16Z-docosatetraenamide
CID 5282273
C18-Ceramide
CID 5283565
Cer(d18:1/22:0)
CID 5283567
C26 Cer
CID 5283570
Cer(d18:1/24:1(15Z))
CID 5283568

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(2-hydroxyethyl)icos-11-enamide?
The IUPAC name of (Z)-N-(2-hydroxyethyl)icos-11-enamide (CID 5283452) is (Z)-N-(2-hydroxyethyl)icos-11-enamide.
What is the SMILES notation for (Z)-N-(2-hydroxyethyl)icos-11-enamide?
The canonical SMILES for (Z)-N-(2-hydroxyethyl)icos-11-enamide is CCCCCCCC/C=C\CCCCCCCCCC(=O)NCCO.
What is the InChIKey of (Z)-N-(2-hydroxyethyl)icos-11-enamide?
The InChIKey is YDKRGMXLBRWZJR-KTKRTIGZSA-N. The full InChI is InChI=1S/C22H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h9-10,24H,2-8,11-21H2,1H3,(H,23,25)/b10-9-.
What are the key properties of (Z)-N-(2-hydroxyethyl)icos-11-enamide?
(Z)-N-(2-hydroxyethyl)icos-11-enamide has a molecular weight of 353.59 g/mol, XLogP of 5.91, 19 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(2-hydroxyethyl)icos-11-enamide is sourced from PubChem (CID 5283452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).