3-(3-methoxy-2-methylpropyl)oxetane

C8H16O2 — CID 70362391

IUPAC3-(3-methoxy-2-methylpropyl)oxetane
SMILESCOCC(C)CC1COC1
InChIInChI=1S/C8H16O2/c1-7(4-9-2)3-8-5-10-6-8/h7-8H,3-6H2,1-2H3
InChIKeyGXNWGBVEWDEYLQ-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.31
Rot. Bonds4

About 3-(3-methoxy-2-methylpropyl)oxetane

3-(3-methoxy-2-methylpropyl)oxetane (PubChem CID 70362391) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 3-(3-methoxy-2-methylpropyl)oxetane.

Molecular Properties

Compound Name3-(3-methoxy-2-methylpropyl)oxetane
PubChem CID70362391
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name3-(3-methoxy-2-methylpropyl)oxetane
SMILESCOCC(C)CC1COC1
InChIInChI=1S/C8H16O2/c1-7(4-9-2)3-8-5-10-6-8/h7-8H,3-6H2,1-2H3
InChIKeyGXNWGBVEWDEYLQ-UHFFFAOYSA-N
XLogP1.31
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxy-2-methylpropyl)oxetane?
The IUPAC name of 3-(3-methoxy-2-methylpropyl)oxetane (CID 70362391) is 3-(3-methoxy-2-methylpropyl)oxetane.
What is the SMILES notation for 3-(3-methoxy-2-methylpropyl)oxetane?
The canonical SMILES for 3-(3-methoxy-2-methylpropyl)oxetane is COCC(C)CC1COC1.
What is the InChIKey of 3-(3-methoxy-2-methylpropyl)oxetane?
The InChIKey is GXNWGBVEWDEYLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-7(4-9-2)3-8-5-10-6-8/h7-8H,3-6H2,1-2H3.
What are the key properties of 3-(3-methoxy-2-methylpropyl)oxetane?
3-(3-methoxy-2-methylpropyl)oxetane has a molecular weight of 144.21 g/mol, XLogP of 1.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxy-2-methylpropyl)oxetane is sourced from PubChem (CID 70362391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).