2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine

C13H28N2O2 — CID 145216939

IUPAC2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine
SMILESCCOCC1CCCN1.COCC1CCCN1
InChIInChI=1S/C7H15NO.C6H13NO/c1-2-9-6-7-4-3-5-8-7;1-8-5-6-3-2-4-7-6/h7-8H,2-6H2,1H3;6-7H,2-5H2,1H3
InChIKeySFQVOPFOSOTDEX-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.16
Rot. Bonds5

About 2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine

2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine (PubChem CID 145216939) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine.

Molecular Properties

Compound Name2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine
PubChem CID145216939
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine
SMILESCCOCC1CCCN1.COCC1CCCN1
InChIInChI=1S/C7H15NO.C6H13NO/c1-2-9-6-7-4-3-5-8-7;1-8-5-6-3-2-4-7-6/h7-8H,2-6H2,1H3;6-7H,2-5H2,1H3
InChIKeySFQVOPFOSOTDEX-UHFFFAOYSA-N
XLogP1.16
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethoxymethyl)azepane
CID 79569846
(2R)-2-(methoxymethyl)pyrrolidine;molecular hydrogen;propane
CID 143635962
2-(4-methoxybutoxymethyl)pyrrolidine
CID 104648269
(2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine
CID 103402661
(2R)-2-(octoxymethyl)pyrrolidine
CID 102820024
1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol
CID 106939406
(2S)-2-(1-ethoxypropan-2-yloxymethyl)pyrrolidine
CID 103488467
2-(methoxymethyl)azetidine
CID 58227482
(2S)-2-(cyclopropylmethoxymethyl)pyrrolidine
CID 59651686
(2R)-2-(cyclopropylmethoxymethyl)pyrrolidine
CID 102820123
(2S)-2-(methylperoxymethyl)pyrrolidine
CID 88881099
ethyl 2-(pyrrolidin-2-ylmethoxy)acetate
CID 106939447

Frequently Asked Questions

What is the IUPAC name of 2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine?
The IUPAC name of 2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine (CID 145216939) is 2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine.
What is the SMILES notation for 2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine?
The canonical SMILES for 2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine is CCOCC1CCCN1.COCC1CCCN1.
What is the InChIKey of 2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine?
The InChIKey is SFQVOPFOSOTDEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.C6H13NO/c1-2-9-6-7-4-3-5-8-7;1-8-5-6-3-2-4-7-6/h7-8H,2-6H2,1H3;6-7H,2-5H2,1H3.
What are the key properties of 2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine?
2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine has a molecular weight of 244.38 g/mol, XLogP of 1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine is sourced from PubChem (CID 145216939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).