3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine

C12H24N2O — CID 64596729

IUPAC3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine
SMILESCOCC1CCN(CC2(C)CCNC2)C1
InChIInChI=1S/C12H24N2O/c1-12(4-5-13-9-12)10-14-6-3-11(7-14)8-15-2/h11,13H,3-10H2,1-2H3
InChIKeyULDUAJMHCCCXMW-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.95
Rot. Bonds4

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

3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine (PubChem CID 64596729) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine.

Molecular Properties

Compound Name3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine
PubChem CID64596729
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine
SMILESCOCC1CCN(CC2(C)CCNC2)C1
InChIInChI=1S/C12H24N2O/c1-12(4-5-13-9-12)10-14-6-3-11(7-14)8-15-2/h11,13H,3-10H2,1-2H3
InChIKeyULDUAJMHCCCXMW-UHFFFAOYSA-N
XLogP0.95
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine
CID 120901494
3-[[4-(methoxymethyl)piperidin-1-yl]methyl]-3-methylpiperidine
CID 63979023
[1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidin-3-yl]methanamine;hydrochloride
CID 131086147
3-(ethoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]piperidine
CID 120900572
N-ethyl-N-[[1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidin-3-yl]methyl]ethanamine
CID 120901182
1-[(3-methylpyrrolidin-3-yl)methyl]-3-methylsulfanylpyrrolidine
CID 130979190
2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-2-methylpyrrolidine
CID 64597347
[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride
CID 120897177
3-[(4-methylpiperidin-1-yl)methyl]-1-[(3-methylpyrrolidin-3-yl)methyl]piperidine
CID 120899331
N,N-diethyl-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidin-3-amine
CID 63536783
1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine
CID 63979218
2,6-dimethyl-4-[[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]methyl]morpholine
CID 120899327

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine?
The IUPAC name of 3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine (CID 64596729) is 3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine.
What is the SMILES notation for 3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine?
The canonical SMILES for 3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine is COCC1CCN(CC2(C)CCNC2)C1.
What is the InChIKey of 3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine?
The InChIKey is ULDUAJMHCCCXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-12(4-5-13-9-12)10-14-6-3-11(7-14)8-15-2/h11,13H,3-10H2,1-2H3.
What are the key properties of 3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine?
3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine has a molecular weight of 212.34 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine is sourced from PubChem (CID 64596729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).