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

C8H17NO2 — CID 20653637

IUPAC4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine
SMILESCOCC1CC(OC)CN1C
InChIInChI=1S/C8H17NO2/c1-9-5-8(11-3)4-7(9)6-10-2/h7-8H,4-6H2,1-3H3
InChIKeyXYZPVCOYAULOJI-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.35
Rot. Bonds3

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

4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine (PubChem CID 20653637) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine.

Molecular Properties

Compound Name4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine
PubChem CID20653637
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine
SMILESCOCC1CC(OC)CN1C
InChIInChI=1S/C8H17NO2/c1-9-5-8(11-3)4-7(9)6-10-2/h7-8H,4-6H2,1-3H3
InChIKeyXYZPVCOYAULOJI-UHFFFAOYSA-N
XLogP0.35
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine?
The IUPAC name of 4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine (CID 20653637) is 4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine.
What is the SMILES notation for 4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine?
The canonical SMILES for 4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine is COCC1CC(OC)CN1C.
What is the InChIKey of 4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine?
The InChIKey is XYZPVCOYAULOJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-9-5-8(11-3)4-7(9)6-10-2/h7-8H,4-6H2,1-3H3.
What are the key properties of 4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine?
4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine has a molecular weight of 159.23 g/mol, XLogP of 0.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(methoxymethyl)-1-methylpyrrolidine is sourced from PubChem (CID 20653637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).