3-(methoxymethyl)-1,3-dimethylpyrrolidine

C8H17NO — CID 144754781

IUPAC3-(methoxymethyl)-1,3-dimethylpyrrolidine
SMILESCOCC1(C)CCN(C)C1
InChIInChI=1S/C8H17NO/c1-8(7-10-3)4-5-9(2)6-8/h4-7H2,1-3H3
InChIKeyAGKFUOREEJLYIS-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.97
Rot. Bonds2

About 3-(methoxymethyl)-1,3-dimethylpyrrolidine

3-(methoxymethyl)-1,3-dimethylpyrrolidine (PubChem CID 144754781) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 3-(methoxymethyl)-1,3-dimethylpyrrolidine.

Molecular Properties

Compound Name3-(methoxymethyl)-1,3-dimethylpyrrolidine
PubChem CID144754781
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name3-(methoxymethyl)-1,3-dimethylpyrrolidine
SMILESCOCC1(C)CCN(C)C1
InChIInChI=1S/C8H17NO/c1-8(7-10-3)4-5-9(2)6-8/h4-7H2,1-3H3
InChIKeyAGKFUOREEJLYIS-UHFFFAOYSA-N
XLogP0.97
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-1,3-dimethylpyrrolidine?
The IUPAC name of 3-(methoxymethyl)-1,3-dimethylpyrrolidine (CID 144754781) is 3-(methoxymethyl)-1,3-dimethylpyrrolidine.
What is the SMILES notation for 3-(methoxymethyl)-1,3-dimethylpyrrolidine?
The canonical SMILES for 3-(methoxymethyl)-1,3-dimethylpyrrolidine is COCC1(C)CCN(C)C1.
What is the InChIKey of 3-(methoxymethyl)-1,3-dimethylpyrrolidine?
The InChIKey is AGKFUOREEJLYIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-8(7-10-3)4-5-9(2)6-8/h4-7H2,1-3H3.
What are the key properties of 3-(methoxymethyl)-1,3-dimethylpyrrolidine?
3-(methoxymethyl)-1,3-dimethylpyrrolidine has a molecular weight of 143.23 g/mol, XLogP of 0.97, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-1,3-dimethylpyrrolidine is sourced from PubChem (CID 144754781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).