3-ethyl-1-methoxy-3-(methoxymethyl)pentane

C10H22O2 — CID 89190117

IUPAC3-ethyl-1-methoxy-3-(methoxymethyl)pentane
SMILESCCC(CC)(CCOC)COC
InChIInChI=1S/C10H22O2/c1-5-10(6-2,9-12-4)7-8-11-3/h5-9H2,1-4H3
InChIKeyUEGQTSVJPRLWQM-UHFFFAOYSA-N
MW174.28 g/mol
LogP2.48
Rot. Bonds7

About 3-ethyl-1-methoxy-3-(methoxymethyl)pentane

3-ethyl-1-methoxy-3-(methoxymethyl)pentane (PubChem CID 89190117) has the molecular formula C10H22O2 and a molecular weight of 174.28 g/mol. Its IUPAC name is 3-ethyl-1-methoxy-3-(methoxymethyl)pentane.

Molecular Properties

Compound Name3-ethyl-1-methoxy-3-(methoxymethyl)pentane
PubChem CID89190117
Molecular FormulaC10H22O2
Molecular Weight174.28 g/mol
Exact Mass174.16
IUPAC Name3-ethyl-1-methoxy-3-(methoxymethyl)pentane
SMILESCCC(CC)(CCOC)COC
InChIInChI=1S/C10H22O2/c1-5-10(6-2,9-12-4)7-8-11-3/h5-9H2,1-4H3
InChIKeyUEGQTSVJPRLWQM-UHFFFAOYSA-N
XLogP2.48
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.28
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-methoxy-3-(methoxymethyl)pentane?
The IUPAC name of 3-ethyl-1-methoxy-3-(methoxymethyl)pentane (CID 89190117) is 3-ethyl-1-methoxy-3-(methoxymethyl)pentane.
What is the SMILES notation for 3-ethyl-1-methoxy-3-(methoxymethyl)pentane?
The canonical SMILES for 3-ethyl-1-methoxy-3-(methoxymethyl)pentane is CCC(CC)(CCOC)COC.
What is the InChIKey of 3-ethyl-1-methoxy-3-(methoxymethyl)pentane?
The InChIKey is UEGQTSVJPRLWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2/c1-5-10(6-2,9-12-4)7-8-11-3/h5-9H2,1-4H3.
What are the key properties of 3-ethyl-1-methoxy-3-(methoxymethyl)pentane?
3-ethyl-1-methoxy-3-(methoxymethyl)pentane has a molecular weight of 174.28 g/mol, XLogP of 2.48, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-methoxy-3-(methoxymethyl)pentane is sourced from PubChem (CID 89190117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).