5-methoxy-5-methylnonane

C11H24O — CID 3801348

IUPAC5-methoxy-5-methylnonane
SMILESCCCCC(C)(CCCC)OC
InChIInChI=1S/C11H24O/c1-5-7-9-11(3,12-4)10-8-6-2/h5-10H2,1-4H3
InChIKeyHOXFACPEYHARBJ-UHFFFAOYSA-N
MW172.31 g/mol
LogP3.77
Rot. Bonds7

About 5-methoxy-5-methylnonane

5-methoxy-5-methylnonane (PubChem CID 3801348) has the molecular formula C11H24O and a molecular weight of 172.31 g/mol. Its IUPAC name is 5-methoxy-5-methylnonane.

Molecular Properties

Compound Name5-methoxy-5-methylnonane
PubChem CID3801348
Molecular FormulaC11H24O
Molecular Weight172.31 g/mol
Exact Mass172.18
IUPAC Name5-methoxy-5-methylnonane
SMILESCCCCC(C)(CCCC)OC
InChIInChI=1S/C11H24O/c1-5-7-9-11(3,12-4)10-8-6-2/h5-10H2,1-4H3
InChIKeyHOXFACPEYHARBJ-UHFFFAOYSA-N
XLogP3.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.31
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-methoxy-5-methylnonane 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-methoxy-5-methylnonane?
The IUPAC name of 5-methoxy-5-methylnonane (CID 3801348) is 5-methoxy-5-methylnonane.
What is the SMILES notation for 5-methoxy-5-methylnonane?
The canonical SMILES for 5-methoxy-5-methylnonane is CCCCC(C)(CCCC)OC.
What is the InChIKey of 5-methoxy-5-methylnonane?
The InChIKey is HOXFACPEYHARBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O/c1-5-7-9-11(3,12-4)10-8-6-2/h5-10H2,1-4H3.
What are the key properties of 5-methoxy-5-methylnonane?
5-methoxy-5-methylnonane has a molecular weight of 172.31 g/mol, XLogP of 3.77, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-5-methylnonane is sourced from PubChem (CID 3801348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).