N-(2-hydroxyethyl)-N-methyloctadecanamide

C21H43NO2 — CID 11067823

IUPACN-(2-hydroxyethyl)-N-methyloctadecanamide
SMILESCCCCCCCCCCCCCCCCCC(=O)N(C)CCO
InChIInChI=1S/C21H43NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(24)22(2)19-20-23/h23H,3-20H2,1-2H3
InChIKeyUOFPCDKBJJVSSD-UHFFFAOYSA-N
MW341.58 g/mol
LogP5.70
Rot. Bonds18

About N-(2-hydroxyethyl)-N-methyloctadecanamide

N-(2-hydroxyethyl)-N-methyloctadecanamide (PubChem CID 11067823) has the molecular formula C21H43NO2 and a molecular weight of 341.58 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methyloctadecanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methyloctadecanamide
PubChem CID11067823
Molecular FormulaC21H43NO2
Molecular Weight341.58 g/mol
Exact Mass341.33
IUPAC NameN-(2-hydroxyethyl)-N-methyloctadecanamide
SMILESCCCCCCCCCCCCCCCCCC(=O)N(C)CCO
InChIInChI=1S/C21H43NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(24)22(2)19-20-23/h23H,3-20H2,1-2H3
InChIKeyUOFPCDKBJJVSSD-UHFFFAOYSA-N
XLogP5.70
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.58
LogP ≤ 55.70
H-Bond Donors ≤ 51
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)-N-methyloctadecanamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methyloctadecanamide (CID 11067823) is N-(2-hydroxyethyl)-N-methyloctadecanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methyloctadecanamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methyloctadecanamide is CCCCCCCCCCCCCCCCCC(=O)N(C)CCO.
What is the InChIKey of N-(2-hydroxyethyl)-N-methyloctadecanamide?
The InChIKey is UOFPCDKBJJVSSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H43NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(24)22(2)19-20-23/h23H,3-20H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-methyloctadecanamide?
N-(2-hydroxyethyl)-N-methyloctadecanamide has a molecular weight of 341.58 g/mol, XLogP of 5.70, 18 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methyloctadecanamide is sourced from PubChem (CID 11067823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).