2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine

C13H26N2O2 — CID 135179078

IUPAC2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine
SMILESCOCC1CCCN1CCOC1CCN(C)C1
InChIInChI=1S/C13H26N2O2/c1-14-7-5-13(10-14)17-9-8-15-6-3-4-12(15)11-16-2/h12-13H,3-11H2,1-2H3
InChIKeyLRSPCXIPBRNPDL-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.82
Rot. Bonds6

About 2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine

2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine (PubChem CID 135179078) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine.

Molecular Properties

Compound Name2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine
PubChem CID135179078
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine
SMILESCOCC1CCCN1CCOC1CCN(C)C1
InChIInChI=1S/C13H26N2O2/c1-14-7-5-13(10-14)17-9-8-15-6-3-4-12(15)11-16-2/h12-13H,3-11H2,1-2H3
InChIKeyLRSPCXIPBRNPDL-UHFFFAOYSA-N
XLogP0.82
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine?
The IUPAC name of 2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine (CID 135179078) is 2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine.
What is the SMILES notation for 2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine?
The canonical SMILES for 2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine is COCC1CCCN1CCOC1CCN(C)C1.
What is the InChIKey of 2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine?
The InChIKey is LRSPCXIPBRNPDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-14-7-5-13(10-14)17-9-8-15-6-3-4-12(15)11-16-2/h12-13H,3-11H2,1-2H3.
What are the key properties of 2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine?
2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine has a molecular weight of 242.36 g/mol, XLogP of 0.82, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-1-[2-(1-methylpyrrolidin-3-yl)oxyethyl]pyrrolidine is sourced from PubChem (CID 135179078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).