N-(2-hydroxyethyl)octadecanamide

C20H41NO2 — CID 27902

IUPACN-(2-hydroxyethyl)octadecanamide
SMILESCCCCCCCCCCCCCCCCCC(=O)NCCO
InChIInChI=1S/C20H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h22H,2-19H2,1H3,(H,21,23)
InChIKeyOTGQIQQTPXJQRG-UHFFFAOYSA-N
MW327.55 g/mol
LogP5.36
Rot. Bonds18

About N-(2-hydroxyethyl)octadecanamide

N-(2-hydroxyethyl)octadecanamide (PubChem CID 27902) has the molecular formula C20H41NO2 and a molecular weight of 327.55 g/mol. Its IUPAC name is N-(2-hydroxyethyl)octadecanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)octadecanamide
PubChem CID27902
Molecular FormulaC20H41NO2
Molecular Weight327.55 g/mol
Exact Mass327.31
IUPAC NameN-(2-hydroxyethyl)octadecanamide
SMILESCCCCCCCCCCCCCCCCCC(=O)NCCO
InChIInChI=1S/C20H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h22H,2-19H2,1H3,(H,21,23)
InChIKeyOTGQIQQTPXJQRG-UHFFFAOYSA-N
XLogP5.36
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.55
LogP ≤ 55.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)octadecanamide?
The IUPAC name of N-(2-hydroxyethyl)octadecanamide (CID 27902) is N-(2-hydroxyethyl)octadecanamide.
What is the SMILES notation for N-(2-hydroxyethyl)octadecanamide?
The canonical SMILES for N-(2-hydroxyethyl)octadecanamide is CCCCCCCCCCCCCCCCCC(=O)NCCO.
What is the InChIKey of N-(2-hydroxyethyl)octadecanamide?
The InChIKey is OTGQIQQTPXJQRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h22H,2-19H2,1H3,(H,21,23).
What are the key properties of N-(2-hydroxyethyl)octadecanamide?
N-(2-hydroxyethyl)octadecanamide has a molecular weight of 327.55 g/mol, XLogP of 5.36, 18 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)octadecanamide is sourced from PubChem (CID 27902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).