2-ethoxy-N-hexadecyl-N-tetradecylacetamide

C34H69NO2 — CID 170646131

IUPAC2-ethoxy-N-hexadecyl-N-tetradecylacetamide
SMILESCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)C(=O)COCC
InChIInChI=1S/C34H69NO2/c1-4-7-9-11-13-15-17-19-20-22-24-26-28-30-32-35(34(36)33-37-6-3)31-29-27-25-23-21-18-16-14-12-10-8-5-2/h4-33H2,1-3H3
InChIKeyGADBDPISPPEYTN-UHFFFAOYSA-N
MW523.93 g/mol
LogP11.03
Rot. Bonds31

About 2-ethoxy-N-hexadecyl-N-tetradecylacetamide

2-ethoxy-N-hexadecyl-N-tetradecylacetamide (PubChem CID 170646131) has the molecular formula C34H69NO2 and a molecular weight of 523.93 g/mol. Its IUPAC name is 2-ethoxy-N-hexadecyl-N-tetradecylacetamide.

Molecular Properties

Compound Name2-ethoxy-N-hexadecyl-N-tetradecylacetamide
PubChem CID170646131
Molecular FormulaC34H69NO2
Molecular Weight523.93 g/mol
Exact Mass523.53
IUPAC Name2-ethoxy-N-hexadecyl-N-tetradecylacetamide
SMILESCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)C(=O)COCC
InChIInChI=1S/C34H69NO2/c1-4-7-9-11-13-15-17-19-20-22-24-26-28-30-32-35(34(36)33-37-6-3)31-29-27-25-23-21-18-16-14-12-10-8-5-2/h4-33H2,1-3H3
InChIKeyGADBDPISPPEYTN-UHFFFAOYSA-N
XLogP11.03
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds31
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500523.93
LogP ≤ 511.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N-didecyl-2-[2-(didecylamino)-2-oxoethoxy]acetamide
CID 71346769
2-[2-(didodecylamino)-2-oxoethoxy]-N,N-didodecylacetamide
CID 71406470
2-[2-(dipentylamino)-2-oxoethoxy]-N,N-dipentylacetamide
CID 102105691
N-butyl-2-ethoxy-N-ethylacetamide
CID 4277867
2-[3-[2-(dioctylamino)-2-oxoethoxy]-2-[[2-(dioctylamino)-2-oxoethoxy]methyl]-2-methylpropoxy]-N,N-dioctylacetamide
CID 174303360
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N,N-di(tetradecyl)acetamide
CID 163192847
N-butyl-N-(2-chloroethyl)-2-ethoxyacetamide
CID 63391075
2-[2-(dimethylamino)ethoxy]-N,N-dipentylacetamide
CID 175987160
2-methoxy-N,N-dipentylacetamide
CID 60776145
2-[2-[ethyl(methyl)amino]ethoxy]-N,N-dihexylacetamide
CID 175987181
2-(1-ethoxy-2-methylpropan-2-yl)oxy-N,N-di(tetradecyl)acetamide
CID 167132315
2-(dibutylphosphorylmethoxy)-N,N-dioctylacetamide
CID 102344381

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-hexadecyl-N-tetradecylacetamide?
The IUPAC name of 2-ethoxy-N-hexadecyl-N-tetradecylacetamide (CID 170646131) is 2-ethoxy-N-hexadecyl-N-tetradecylacetamide.
What is the SMILES notation for 2-ethoxy-N-hexadecyl-N-tetradecylacetamide?
The canonical SMILES for 2-ethoxy-N-hexadecyl-N-tetradecylacetamide is CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)C(=O)COCC.
What is the InChIKey of 2-ethoxy-N-hexadecyl-N-tetradecylacetamide?
The InChIKey is GADBDPISPPEYTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H69NO2/c1-4-7-9-11-13-15-17-19-20-22-24-26-28-30-32-35(34(36)33-37-6-3)31-29-27-25-23-21-18-16-14-12-10-8-5-2/h4-33H2,1-3H3.
What are the key properties of 2-ethoxy-N-hexadecyl-N-tetradecylacetamide?
2-ethoxy-N-hexadecyl-N-tetradecylacetamide has a molecular weight of 523.93 g/mol, XLogP of 11.03, 31 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-hexadecyl-N-tetradecylacetamide is sourced from PubChem (CID 170646131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).