3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane

C18H34O5 — CID 59339949

IUPAC3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane
SMILESCCC1(COCC(C)OCC(C)OCC2(CC)COC2)COC1
InChIInChI=1S/C18H34O5/c1-5-17(10-20-11-17)9-19-7-15(3)22-8-16(4)23-14-18(6-2)12-21-13-18/h15-16H,5-14H2,1-4H3
InChIKeyDTMCIJIIPRPZLK-UHFFFAOYSA-N
MW330.47 g/mol
LogP2.67
Rot. Bonds12

About 3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane

3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane (PubChem CID 59339949) has the molecular formula C18H34O5 and a molecular weight of 330.47 g/mol. Its IUPAC name is 3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane.

Molecular Properties

Compound Name3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane
PubChem CID59339949
Molecular FormulaC18H34O5
Molecular Weight330.47 g/mol
Exact Mass330.24
IUPAC Name3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane
SMILESCCC1(COCC(C)OCC(C)OCC2(CC)COC2)COC1
InChIInChI=1S/C18H34O5/c1-5-17(10-20-11-17)9-19-7-15(3)22-8-16(4)23-14-18(6-2)12-21-13-18/h15-16H,5-14H2,1-4H3
InChIKeyDTMCIJIIPRPZLK-UHFFFAOYSA-N
XLogP2.67
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.47
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-Ethyl-3-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxymethyl]oxetane
CID 11253923
3-[2,2-Bis[(3-methyloxetan-3-yl)methoxymethyl]butoxymethyl]-3-methyloxetane
CID 11825221
2-Tert-butyl-1,4,7,10,13,16-hexaoxacyclooctadecane
CID 14814455
3-Ethyl-3-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxymethyl]oxetane
CID 21133030
3,3'-(((2,2-Bis(((3-ethyloxetan-3-yl)methoxy)methyl)propane-1,3-diyl)bis(oxy))bis(methylene))bis(3-ethyloxetane)
CID 22340176
3-[2,2-Bis[(3-ethyloxetan-3-yl)methoxymethyl]butoxymethyl]-3-ethyloxetane
CID 22340181
3-Ethyl-3-[2-[2-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]ethoxy]ethoxymethyl]oxetane
CID 57141474
3-Ethyl-3-[1-[1-(3-ethyloxetan-3-yl)-2-(2-methylpropoxy)ethoxy]-2-(2-methylpropoxy)ethyl]oxetane
CID 57186025
3-Ethyl-3-[2-[2-[2-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxetane
CID 57319993
1,3-Bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol
CID 57493389
3-Ethyl-3-[[3-[(3-ethyloxetan-3-yl)methoxy]-2-methoxypropoxy]methyl]oxetane
CID 57826959
3-Ethyl-3-[4-[2-[[3-[4-[2-[[3-[4-[2-[[3-[4-(2-methoxyethoxy)butoxymethyl]oxetan-3-yl]methoxy]ethoxy]butoxymethyl]oxetan-3-yl]methoxy]ethoxy]butoxymethyl]oxetan-3-yl]methoxy]ethoxy]butoxymethyl]oxetane
CID 58350245

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane?
The IUPAC name of 3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane (CID 59339949) is 3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane.
What is the SMILES notation for 3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane?
The canonical SMILES for 3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane is CCC1(COCC(C)OCC(C)OCC2(CC)COC2)COC1.
What is the InChIKey of 3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane?
The InChIKey is DTMCIJIIPRPZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O5/c1-5-17(10-20-11-17)9-19-7-15(3)22-8-16(4)23-14-18(6-2)12-21-13-18/h15-16H,5-14H2,1-4H3.
What are the key properties of 3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane?
3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane has a molecular weight of 330.47 g/mol, XLogP of 2.67, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-[1-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxy]propan-2-yloxymethyl]oxetane is sourced from PubChem (CID 59339949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).