3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane

C13H24O4 — CID 58908006

IUPAC3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane
SMILESCCC1(CCCC2COC2OC)COC1OC
InChIInChI=1S/C13H24O4/c1-4-13(9-17-12(13)15-3)7-5-6-10-8-16-11(10)14-2/h10-12H,4-9H2,1-3H3
InChIKeyCJKIGRZGNRHTSN-UHFFFAOYSA-N
MW244.33 g/mol
LogP2.17
Rot. Bonds7

About 3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane

3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane (PubChem CID 58908006) has the molecular formula C13H24O4 and a molecular weight of 244.33 g/mol. Its IUPAC name is 3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane.

Molecular Properties

Compound Name3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane
PubChem CID58908006
Molecular FormulaC13H24O4
Molecular Weight244.33 g/mol
Exact Mass244.17
IUPAC Name3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane
SMILESCCC1(CCCC2COC2OC)COC1OC
InChIInChI=1S/C13H24O4/c1-4-13(9-17-12(13)15-3)7-5-6-10-8-16-11(10)14-2/h10-12H,4-9H2,1-3H3
InChIKeyCJKIGRZGNRHTSN-UHFFFAOYSA-N
XLogP2.17
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane?
The IUPAC name of 3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane (CID 58908006) is 3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane.
What is the SMILES notation for 3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane?
The canonical SMILES for 3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane is CCC1(CCCC2COC2OC)COC1OC.
What is the InChIKey of 3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane?
The InChIKey is CJKIGRZGNRHTSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O4/c1-4-13(9-17-12(13)15-3)7-5-6-10-8-16-11(10)14-2/h10-12H,4-9H2,1-3H3.
What are the key properties of 3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane?
3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane has a molecular weight of 244.33 g/mol, XLogP of 2.17, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methoxy-3-[3-(2-methoxyoxetan-3-yl)propyl]oxetane is sourced from PubChem (CID 58908006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).