2-methoxyoxane;3-methyl-2-methylideneoxetane

C11H20O3 — CID 161197954

IUPAC2-methoxyoxane;3-methyl-2-methylideneoxetane
SMILESC=C1OCC1C.COC1CCCCO1
InChIInChI=1S/C6H12O2.C5H8O/c1-7-6-4-2-3-5-8-6;1-4-3-6-5(4)2/h6H,2-5H2,1H3;4H,2-3H2,1H3
InChIKeyUUPDQMORWNWVHN-UHFFFAOYSA-N
MW200.28 g/mol
LogP2.33
Rot. Bonds1

About 2-methoxyoxane;3-methyl-2-methylideneoxetane

2-methoxyoxane;3-methyl-2-methylideneoxetane (PubChem CID 161197954) has the molecular formula C11H20O3 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-methoxyoxane;3-methyl-2-methylideneoxetane.

Molecular Properties

Compound Name2-methoxyoxane;3-methyl-2-methylideneoxetane
PubChem CID161197954
Molecular FormulaC11H20O3
Molecular Weight200.28 g/mol
Exact Mass200.14
IUPAC Name2-methoxyoxane;3-methyl-2-methylideneoxetane
SMILESC=C1OCC1C.COC1CCCCO1
InChIInChI=1S/C6H12O2.C5H8O/c1-7-6-4-2-3-5-8-6;1-4-3-6-5(4)2/h6H,2-5H2,1H3;4H,2-3H2,1H3
InChIKeyUUPDQMORWNWVHN-UHFFFAOYSA-N
XLogP2.33
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxyoxane;3-methyl-2-methylideneoxetane?
The IUPAC name of 2-methoxyoxane;3-methyl-2-methylideneoxetane (CID 161197954) is 2-methoxyoxane;3-methyl-2-methylideneoxetane.
What is the SMILES notation for 2-methoxyoxane;3-methyl-2-methylideneoxetane?
The canonical SMILES for 2-methoxyoxane;3-methyl-2-methylideneoxetane is C=C1OCC1C.COC1CCCCO1.
What is the InChIKey of 2-methoxyoxane;3-methyl-2-methylideneoxetane?
The InChIKey is UUPDQMORWNWVHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O2.C5H8O/c1-7-6-4-2-3-5-8-6;1-4-3-6-5(4)2/h6H,2-5H2,1H3;4H,2-3H2,1H3.
What are the key properties of 2-methoxyoxane;3-methyl-2-methylideneoxetane?
2-methoxyoxane;3-methyl-2-methylideneoxetane has a molecular weight of 200.28 g/mol, XLogP of 2.33, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyoxane;3-methyl-2-methylideneoxetane is sourced from PubChem (CID 161197954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).