4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine

C9H19NO2 — CID 69169504

IUPAC4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine
SMILESCCOC1CC(COC)N(C)C1
InChIInChI=1S/C9H19NO2/c1-4-12-9-5-8(7-11-3)10(2)6-9/h8-9H,4-7H2,1-3H3
InChIKeyGZDZMLBUWCYDPC-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.74
Rot. Bonds4

About 4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine

4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine (PubChem CID 69169504) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine.

Molecular Properties

Compound Name4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine
PubChem CID69169504
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine
SMILESCCOC1CC(COC)N(C)C1
InChIInChI=1S/C9H19NO2/c1-4-12-9-5-8(7-11-3)10(2)6-9/h8-9H,4-7H2,1-3H3
InChIKeyGZDZMLBUWCYDPC-UHFFFAOYSA-N
XLogP0.74
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine?
The IUPAC name of 4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine (CID 69169504) is 4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine.
What is the SMILES notation for 4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine?
The canonical SMILES for 4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine is CCOC1CC(COC)N(C)C1.
What is the InChIKey of 4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine?
The InChIKey is GZDZMLBUWCYDPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-4-12-9-5-8(7-11-3)10(2)6-9/h8-9H,4-7H2,1-3H3.
What are the key properties of 4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine?
4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine has a molecular weight of 173.26 g/mol, XLogP of 0.74, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-2-(methoxymethyl)-1-methylpyrrolidine is sourced from PubChem (CID 69169504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).