3-(methoxymethyl)pyrrolidine

C6H13NO — CID 22993433

IUPAC3-(methoxymethyl)pyrrolidine
SMILESCOCC1CCNC1
InChIInChI=1S/C6H13NO/c1-8-5-6-2-3-7-4-6/h6-7H,2-5H2,1H3
InChIKeyGTINRJGGSAKCEO-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.24
Rot. Bonds2

About 3-(methoxymethyl)pyrrolidine

3-(methoxymethyl)pyrrolidine (PubChem CID 22993433) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 3-(methoxymethyl)pyrrolidine.

Molecular Properties

Compound Name3-(methoxymethyl)pyrrolidine
PubChem CID22993433
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name3-(methoxymethyl)pyrrolidine
SMILESCOCC1CCNC1
InChIInChI=1S/C6H13NO/c1-8-5-6-2-3-7-4-6/h6-7H,2-5H2,1H3
InChIKeyGTINRJGGSAKCEO-UHFFFAOYSA-N
XLogP0.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)pyrrolidine?
The IUPAC name of 3-(methoxymethyl)pyrrolidine (CID 22993433) is 3-(methoxymethyl)pyrrolidine.
What is the SMILES notation for 3-(methoxymethyl)pyrrolidine?
The canonical SMILES for 3-(methoxymethyl)pyrrolidine is COCC1CCNC1.
What is the InChIKey of 3-(methoxymethyl)pyrrolidine?
The InChIKey is GTINRJGGSAKCEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-8-5-6-2-3-7-4-6/h6-7H,2-5H2,1H3.
What are the key properties of 3-(methoxymethyl)pyrrolidine?
3-(methoxymethyl)pyrrolidine has a molecular weight of 115.18 g/mol, XLogP of 0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)pyrrolidine is sourced from PubChem (CID 22993433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).