3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane

C15H16O3 — CID 116876018

IUPAC3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane
SMILESCOc1ccc2cc(C3(OC)COC3)ccc2c1
InChIInChI=1S/C15H16O3/c1-16-14-6-4-11-7-13(5-3-12(11)8-14)15(17-2)9-18-10-15/h3-8H,9-10H2,1-2H3
InChIKeyCJQBWKKTJGDDNH-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.72
Rot. Bonds3

About 3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane

3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane (PubChem CID 116876018) has the molecular formula C15H16O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is 3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane.

Molecular Properties

Compound Name3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane
PubChem CID116876018
Molecular FormulaC15H16O3
Molecular Weight244.29 g/mol
Exact Mass244.11
IUPAC Name3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane
SMILESCOc1ccc2cc(C3(OC)COC3)ccc2c1
InChIInChI=1S/C15H16O3/c1-16-14-6-4-11-7-13(5-3-12(11)8-14)15(17-2)9-18-10-15/h3-8H,9-10H2,1-2H3
InChIKeyCJQBWKKTJGDDNH-UHFFFAOYSA-N
XLogP2.72
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-3-(6-methoxynaphthalen-2-yl)oxetane
CID 116876570
1-[3-(6-methoxynaphthalen-2-yl)oxetan-3-yl]ethanamine
CID 116869429
3-(6-methoxynaphthalen-2-yl)oxetane-3-carboxylic acid
CID 116871824
3-(6-methoxynaphthalen-2-yl)azetidin-3-amine
CID 166607932
4-(3-methoxyoxetan-3-yl)aniline
CID 90422102
3-methoxy-3-(4-methylsulfanylphenyl)oxetane
CID 116875976
2-[(1S)-1-bromoethyl]-2-(6-methoxynaphthalen-2-yl)-5,5-dimethyl-1,3-dioxane
CID 54472939
2-[(1S)-1-bromoethyl]-2-(6-methoxynaphthalen-2-yl)-1,3-dioxolane
CID 18602098
[1-(6-methoxynaphthalen-2-yl)-2-methylcyclopropyl]methanol
CID 116842587
4-(6-methoxynaphthalen-2-yl)piperidin-4-ol;hydrochloride
CID 142647916
3-(6-methoxynaphthalen-2-yl)-8-oxo-8λ4-thiabicyclo[3.2.1]octan-3-ol
CID 171957356
2-(6-methoxynaphthalen-2-yl)-2-methylcyclopropane-1-carboxylic acid
CID 62387826

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane?
The IUPAC name of 3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane (CID 116876018) is 3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane.
What is the SMILES notation for 3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane?
The canonical SMILES for 3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane is COc1ccc2cc(C3(OC)COC3)ccc2c1.
What is the InChIKey of 3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane?
The InChIKey is CJQBWKKTJGDDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O3/c1-16-14-6-4-11-7-13(5-3-12(11)8-14)15(17-2)9-18-10-15/h3-8H,9-10H2,1-2H3.
What are the key properties of 3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane?
3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane has a molecular weight of 244.29 g/mol, XLogP of 2.72, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-3-(6-methoxynaphthalen-2-yl)oxetane is sourced from PubChem (CID 116876018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).