3-(methoxymethoxy)pyrrolidine

C6H13NO2 — CID 18359021

IUPAC3-(methoxymethoxy)pyrrolidine
SMILESCOCOC1CCNC1
InChIInChI=1S/C6H13NO2/c1-8-5-9-6-2-3-7-4-6/h6-7H,2-5H2,1H3
InChIKeyMWGPNRQVCPJJBW-UHFFFAOYSA-N
MW131.18 g/mol
LogP-0.03
Rot. Bonds3

About 3-(methoxymethoxy)pyrrolidine

3-(methoxymethoxy)pyrrolidine (PubChem CID 18359021) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is 3-(methoxymethoxy)pyrrolidine.

Molecular Properties

Compound Name3-(methoxymethoxy)pyrrolidine
PubChem CID18359021
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC Name3-(methoxymethoxy)pyrrolidine
SMILESCOCOC1CCNC1
InChIInChI=1S/C6H13NO2/c1-8-5-9-6-2-3-7-4-6/h6-7H,2-5H2,1H3
InChIKeyMWGPNRQVCPJJBW-UHFFFAOYSA-N
XLogP-0.03
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethoxy)pyrrolidine?
The IUPAC name of 3-(methoxymethoxy)pyrrolidine (CID 18359021) is 3-(methoxymethoxy)pyrrolidine.
What is the SMILES notation for 3-(methoxymethoxy)pyrrolidine?
The canonical SMILES for 3-(methoxymethoxy)pyrrolidine is COCOC1CCNC1.
What is the InChIKey of 3-(methoxymethoxy)pyrrolidine?
The InChIKey is MWGPNRQVCPJJBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-8-5-9-6-2-3-7-4-6/h6-7H,2-5H2,1H3.
What are the key properties of 3-(methoxymethoxy)pyrrolidine?
3-(methoxymethoxy)pyrrolidine has a molecular weight of 131.18 g/mol, XLogP of -0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethoxy)pyrrolidine is sourced from PubChem (CID 18359021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).