3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane

C15H28O2 — CID 23541444

IUPAC3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane
SMILESCCC1(CCCC2(CC)COC2C)COC1C
InChIInChI=1S/C15H28O2/c1-5-14(10-16-12(14)3)8-7-9-15(6-2)11-17-13(15)4/h12-13H,5-11H2,1-4H3
InChIKeyRDNQEXYFKYMMBQ-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.79
Rot. Bonds6

About 3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane

3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane (PubChem CID 23541444) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane.

Molecular Properties

Compound Name3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane
PubChem CID23541444
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane
SMILESCCC1(CCCC2(CC)COC2C)COC1C
InChIInChI=1S/C15H28O2/c1-5-14(10-16-12(14)3)8-7-9-15(6-2)11-17-13(15)4/h12-13H,5-11H2,1-4H3
InChIKeyRDNQEXYFKYMMBQ-UHFFFAOYSA-N
XLogP3.79
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane?
The IUPAC name of 3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane (CID 23541444) is 3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane.
What is the SMILES notation for 3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane?
The canonical SMILES for 3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane is CCC1(CCCC2(CC)COC2C)COC1C.
What is the InChIKey of 3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane?
The InChIKey is RDNQEXYFKYMMBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-5-14(10-16-12(14)3)8-7-9-15(6-2)11-17-13(15)4/h12-13H,5-11H2,1-4H3.
What are the key properties of 3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane?
3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane has a molecular weight of 240.39 g/mol, XLogP of 3.79, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-[3-(3-ethyl-2-methyloxetan-3-yl)propyl]-2-methyloxetane is sourced from PubChem (CID 23541444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).