2-[2-(dioctylamino)-2-oxoethoxy]acetamide

C20H40N2O3 — CID 54763310

IUPAC2-[2-(dioctylamino)-2-oxoethoxy]acetamide
SMILESCCCCCCCCN(CCCCCCCC)C(=O)COCC(N)=O
InChIInChI=1S/C20H40N2O3/c1-3-5-7-9-11-13-15-22(16-14-12-10-8-6-4-2)20(24)18-25-17-19(21)23/h3-18H2,1-2H3,(H2,21,23)
InChIKeyOJVGGGLUMMGWLC-UHFFFAOYSA-N
MW356.55 g/mol
LogP4.04
Rot. Bonds18

About 2-[2-(dioctylamino)-2-oxoethoxy]acetamide

2-[2-(dioctylamino)-2-oxoethoxy]acetamide (PubChem CID 54763310) has the molecular formula C20H40N2O3 and a molecular weight of 356.55 g/mol. Its IUPAC name is 2-[2-(dioctylamino)-2-oxoethoxy]acetamide.

Molecular Properties

Compound Name2-[2-(dioctylamino)-2-oxoethoxy]acetamide
PubChem CID54763310
Molecular FormulaC20H40N2O3
Molecular Weight356.55 g/mol
Exact Mass356.30
IUPAC Name2-[2-(dioctylamino)-2-oxoethoxy]acetamide
SMILESCCCCCCCCN(CCCCCCCC)C(=O)COCC(N)=O
InChIInChI=1S/C20H40N2O3/c1-3-5-7-9-11-13-15-22(16-14-12-10-8-6-4-2)20(24)18-25-17-19(21)23/h3-18H2,1-2H3,(H2,21,23)
InChIKeyOJVGGGLUMMGWLC-UHFFFAOYSA-N
XLogP4.04
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds18
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.55
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 2-[2-(dioctylamino)-2-oxoethoxy]acetamide?
The IUPAC name of 2-[2-(dioctylamino)-2-oxoethoxy]acetamide (CID 54763310) is 2-[2-(dioctylamino)-2-oxoethoxy]acetamide.
What is the SMILES notation for 2-[2-(dioctylamino)-2-oxoethoxy]acetamide?
The canonical SMILES for 2-[2-(dioctylamino)-2-oxoethoxy]acetamide is CCCCCCCCN(CCCCCCCC)C(=O)COCC(N)=O.
What is the InChIKey of 2-[2-(dioctylamino)-2-oxoethoxy]acetamide?
The InChIKey is OJVGGGLUMMGWLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40N2O3/c1-3-5-7-9-11-13-15-22(16-14-12-10-8-6-4-2)20(24)18-25-17-19(21)23/h3-18H2,1-2H3,(H2,21,23).
What are the key properties of 2-[2-(dioctylamino)-2-oxoethoxy]acetamide?
2-[2-(dioctylamino)-2-oxoethoxy]acetamide has a molecular weight of 356.55 g/mol, XLogP of 4.04, 18 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dioctylamino)-2-oxoethoxy]acetamide is sourced from PubChem (CID 54763310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).