3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide

C9H19NO4 — CID 58019725

IUPAC3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide
SMILESCNC(=O)CCOCCOCCOC
InChIInChI=1S/C9H19NO4/c1-10-9(11)3-4-13-7-8-14-6-5-12-2/h3-8H2,1-2H3,(H,10,11)
InChIKeyMLUYHOIUMPMFEK-UHFFFAOYSA-N
MW205.25 g/mol
LogP-0.20
Rot. Bonds9

About 3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide

3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide (PubChem CID 58019725) has the molecular formula C9H19NO4 and a molecular weight of 205.25 g/mol. Its IUPAC name is 3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide.

Molecular Properties

Compound Name3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide
PubChem CID58019725
Molecular FormulaC9H19NO4
Molecular Weight205.25 g/mol
Exact Mass205.13
IUPAC Name3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide
SMILESCNC(=O)CCOCCOCCOC
InChIInChI=1S/C9H19NO4/c1-10-9(11)3-4-13-7-8-14-6-5-12-2/h3-8H2,1-2H3,(H,10,11)
InChIKeyMLUYHOIUMPMFEK-UHFFFAOYSA-N
XLogP-0.20
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.25
LogP ≤ 5-0.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide?
The IUPAC name of 3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide (CID 58019725) is 3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide.
What is the SMILES notation for 3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide?
The canonical SMILES for 3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide is CNC(=O)CCOCCOCCOC.
What is the InChIKey of 3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide?
The InChIKey is MLUYHOIUMPMFEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO4/c1-10-9(11)3-4-13-7-8-14-6-5-12-2/h3-8H2,1-2H3,(H,10,11).
What are the key properties of 3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide?
3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide has a molecular weight of 205.25 g/mol, XLogP of -0.20, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide is sourced from PubChem (CID 58019725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).