5-ethyl-5-methoxynonane

C12H26O — CID 20783230

IUPAC5-ethyl-5-methoxynonane
SMILESCCCCC(CC)(CCCC)OC
InChIInChI=1S/C12H26O/c1-5-8-10-12(7-3,13-4)11-9-6-2/h5-11H2,1-4H3
InChIKeyAUYBSDLIYQODRR-UHFFFAOYSA-N
MW186.34 g/mol
LogP4.16
Rot. Bonds8

About 5-ethyl-5-methoxynonane

5-ethyl-5-methoxynonane (PubChem CID 20783230) has the molecular formula C12H26O and a molecular weight of 186.34 g/mol. Its IUPAC name is 5-ethyl-5-methoxynonane.

Molecular Properties

Compound Name5-ethyl-5-methoxynonane
PubChem CID20783230
Molecular FormulaC12H26O
Molecular Weight186.34 g/mol
Exact Mass186.20
IUPAC Name5-ethyl-5-methoxynonane
SMILESCCCCC(CC)(CCCC)OC
InChIInChI=1S/C12H26O/c1-5-8-10-12(7-3,13-4)11-9-6-2/h5-11H2,1-4H3
InChIKeyAUYBSDLIYQODRR-UHFFFAOYSA-N
XLogP4.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-ethyl-5-methoxynonane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Cyclododecane, 1-methoxy-1-methyl-
CID 161949
3-Methoxy-3-methylhexane
CID 560189
2-Methoxy-2-methylheptane
CID 12663431
2,2-Dipropyloxirane
CID 13411011
2-Methoxy-2-methylnonane
CID 12714348
1-Methoxy-1-methylcyclohexane
CID 13111011
2-Methoxy-2-methylhexane
CID 13725030
2,2-Dibutyloxirane
CID 14836302
2-Methoxy-2-methylundecane
CID 15635904
1-Ethyl-cyclopentyl methyl ether
CID 21039860
Dipropylather
CID 59678235
5-Butyl-5-methoxynonane
CID 85981833

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-5-methoxynonane?
The IUPAC name of 5-ethyl-5-methoxynonane (CID 20783230) is 5-ethyl-5-methoxynonane.
What is the SMILES notation for 5-ethyl-5-methoxynonane?
The canonical SMILES for 5-ethyl-5-methoxynonane is CCCCC(CC)(CCCC)OC.
What is the InChIKey of 5-ethyl-5-methoxynonane?
The InChIKey is AUYBSDLIYQODRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O/c1-5-8-10-12(7-3,13-4)11-9-6-2/h5-11H2,1-4H3.
What are the key properties of 5-ethyl-5-methoxynonane?
5-ethyl-5-methoxynonane has a molecular weight of 186.34 g/mol, XLogP of 4.16, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-5-methoxynonane is sourced from PubChem (CID 20783230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).