5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane

C13H22O — CID 147357384

IUPAC5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane
SMILESCCOC1CC2CC3CC(C)CC1C32
InChIInChI=1S/C13H22O/c1-3-14-12-7-10-6-9-4-8(2)5-11(12)13(9)10/h8-13H,3-7H2,1-2H3
InChIKeyDGOSBKURMQAOCO-UHFFFAOYSA-N
MW194.32 g/mol
LogP3.09
Rot. Bonds2

About 5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane

5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane (PubChem CID 147357384) has the molecular formula C13H22O and a molecular weight of 194.32 g/mol. Its IUPAC name is 5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane.

Molecular Properties

Compound Name5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane
PubChem CID147357384
Molecular FormulaC13H22O
Molecular Weight194.32 g/mol
Exact Mass194.17
IUPAC Name5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane
SMILESCCOC1CC2CC3CC(C)CC1C32
InChIInChI=1S/C13H22O/c1-3-14-12-7-10-6-9-4-8(2)5-11(12)13(9)10/h8-13H,3-7H2,1-2H3
InChIKeyDGOSBKURMQAOCO-UHFFFAOYSA-N
XLogP3.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane?
The IUPAC name of 5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane (CID 147357384) is 5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane.
What is the SMILES notation for 5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane?
The canonical SMILES for 5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane is CCOC1CC2CC3CC(C)CC1C32.
What is the InChIKey of 5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane?
The InChIKey is DGOSBKURMQAOCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O/c1-3-14-12-7-10-6-9-4-8(2)5-11(12)13(9)10/h8-13H,3-7H2,1-2H3.
What are the key properties of 5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane?
5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane has a molecular weight of 194.32 g/mol, XLogP of 3.09, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-8-methyltricyclo[4.3.1.03,10]decane is sourced from PubChem (CID 147357384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).