2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane

C14H26O3 — CID 164901003

IUPAC2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane
SMILESCCC1CCC(COCC2CCC(CC)O2)O1
InChIInChI=1S/C14H26O3/c1-3-11-5-7-13(16-11)9-15-10-14-8-6-12(4-2)17-14/h11-14H,3-10H2,1-2H3
InChIKeyYHFUREUIYAPKGY-UHFFFAOYSA-N
MW242.36 g/mol
LogP2.92
Rot. Bonds6

About 2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane

2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane (PubChem CID 164901003) has the molecular formula C14H26O3 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane.

Molecular Properties

Compound Name2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane
PubChem CID164901003
Molecular FormulaC14H26O3
Molecular Weight242.36 g/mol
Exact Mass242.19
IUPAC Name2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane
SMILESCCC1CCC(COCC2CCC(CC)O2)O1
InChIInChI=1S/C14H26O3/c1-3-11-5-7-13(16-11)9-15-10-14-8-6-12(4-2)17-14/h11-14H,3-10H2,1-2H3
InChIKeyYHFUREUIYAPKGY-UHFFFAOYSA-N
XLogP2.92
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane?
The IUPAC name of 2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane (CID 164901003) is 2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane.
What is the SMILES notation for 2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane?
The canonical SMILES for 2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane is CCC1CCC(COCC2CCC(CC)O2)O1.
What is the InChIKey of 2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane?
The InChIKey is YHFUREUIYAPKGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O3/c1-3-11-5-7-13(16-11)9-15-10-14-8-6-12(4-2)17-14/h11-14H,3-10H2,1-2H3.
What are the key properties of 2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane?
2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane has a molecular weight of 242.36 g/mol, XLogP of 2.92, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-[(5-ethyloxolan-2-yl)methoxymethyl]oxolane is sourced from PubChem (CID 164901003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).