2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide

C7H15NO4 — CID 142368848

IUPAC2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide
SMILESCNC(=O)COCCOCCO
InChIInChI=1S/C7H15NO4/c1-8-7(10)6-12-5-4-11-3-2-9/h9H,2-6H2,1H3,(H,8,10)
InChIKeyKPACEMWELSHXOA-UHFFFAOYSA-N
MW177.20 g/mol
LogP-1.24
Rot. Bonds7

About 2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide

2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide (PubChem CID 142368848) has the molecular formula C7H15NO4 and a molecular weight of 177.20 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide.

Molecular Properties

Compound Name2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide
PubChem CID142368848
Molecular FormulaC7H15NO4
Molecular Weight177.20 g/mol
Exact Mass177.10
IUPAC Name2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide
SMILESCNC(=O)COCCOCCO
InChIInChI=1S/C7H15NO4/c1-8-7(10)6-12-5-4-11-3-2-9/h9H,2-6H2,1H3,(H,8,10)
InChIKeyKPACEMWELSHXOA-UHFFFAOYSA-N
XLogP-1.24
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 5-1.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(2-hydroxyethoxy)ethoxy]-N-methylacetamide?
The IUPAC name of 2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide (CID 142368848) is 2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide.
What is the SMILES notation for 2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide?
The canonical SMILES for 2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide is CNC(=O)COCCOCCO.
What is the InChIKey of 2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide?
The InChIKey is KPACEMWELSHXOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO4/c1-8-7(10)6-12-5-4-11-3-2-9/h9H,2-6H2,1H3,(H,8,10).
What are the key properties of 2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide?
2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide has a molecular weight of 177.20 g/mol, XLogP of -1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethoxy)ethoxy]-N-methylacetamide is sourced from PubChem (CID 142368848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).