3-methoxy-3-propyloxetane

C7H14O2 — CID 54458452

IUPAC3-methoxy-3-propyloxetane
SMILESCCCC1(OC)COC1
InChIInChI=1S/C7H14O2/c1-3-4-7(8-2)5-9-6-7/h3-6H2,1-2H3
InChIKeyLTNAEKUPGMLFLR-UHFFFAOYSA-N
MW130.19 g/mol
LogP1.20
Rot. Bonds3

About 3-methoxy-3-propyloxetane

3-methoxy-3-propyloxetane (PubChem CID 54458452) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is 3-methoxy-3-propyloxetane.

Molecular Properties

Compound Name3-methoxy-3-propyloxetane
PubChem CID54458452
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name3-methoxy-3-propyloxetane
SMILESCCCC1(OC)COC1
InChIInChI=1S/C7H14O2/c1-3-4-7(8-2)5-9-6-7/h3-6H2,1-2H3
InChIKeyLTNAEKUPGMLFLR-UHFFFAOYSA-N
XLogP1.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Ethyl-2-(methoxymethyl)oxetane
CID 174494138
1,2-Dimethoxy-2-methylpentane
CID 13444241
3-Methyl-3-propyl-1,2-dioxetane
CID 18913364
3-Ethyl-3-methoxyoxetane
CID 22277879
3-Ethoxy-3-ethyloxetane
CID 23579058
3-Butyl-3-methoxyoxetane
CID 53909740
3-Propyloxetan-3-ol
CID 54092188
3-Propoxy-3-propyloxetane
CID 91380803
3-Methoxy-3-(2-methylpropyl)oxetane
CID 117550966
3-(2-Methylpropyl)-3-(trideuteriomethoxy)oxetane
CID 121368622
3-Ethyl-3-pentoxyoxetane
CID 176289382

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-3-propyloxetane?
The IUPAC name of 3-methoxy-3-propyloxetane (CID 54458452) is 3-methoxy-3-propyloxetane.
What is the SMILES notation for 3-methoxy-3-propyloxetane?
The canonical SMILES for 3-methoxy-3-propyloxetane is CCCC1(OC)COC1.
What is the InChIKey of 3-methoxy-3-propyloxetane?
The InChIKey is LTNAEKUPGMLFLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O2/c1-3-4-7(8-2)5-9-6-7/h3-6H2,1-2H3.
What are the key properties of 3-methoxy-3-propyloxetane?
3-methoxy-3-propyloxetane has a molecular weight of 130.19 g/mol, XLogP of 1.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-3-propyloxetane is sourced from PubChem (CID 54458452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).