1-methoxy-1-methylcyclononane

C11H22O — CID 123479365

IUPAC1-methoxy-1-methylcyclononane
SMILESCOC1(C)CCCCCCCC1
InChIInChI=1S/C11H22O/c1-11(12-2)9-7-5-3-4-6-8-10-11/h3-10H2,1-2H3
InChIKeyXHKJRPQDRLKVIX-UHFFFAOYSA-N
MW170.30 g/mol
LogP3.53
Rot. Bonds1

About 1-methoxy-1-methylcyclononane

1-methoxy-1-methylcyclononane (PubChem CID 123479365) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is 1-methoxy-1-methylcyclononane.

Molecular Properties

Compound Name1-methoxy-1-methylcyclononane
PubChem CID123479365
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name1-methoxy-1-methylcyclononane
SMILESCOC1(C)CCCCCCCC1
InChIInChI=1S/C11H22O/c1-11(12-2)9-7-5-3-4-6-8-10-11/h3-10H2,1-2H3
InChIKeyXHKJRPQDRLKVIX-UHFFFAOYSA-N
XLogP3.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-methoxy-1-methylcyclodecane
CID 23154687
5-methoxy-5-methylazonane
CID 137425996
1-methoxy-1-(1-methoxycyclohexyl)cyclohexane
CID 90308314
4-methoxy-1,4-dimethylcyclohexan-1-amine
CID 90857551
1,1-difluoro-4-methoxy-4-methylcyclohexane
CID 122579761
bis(1-methylcyclohexyl) hydrogen phosphite
CID 154127230
CID 66889758
CID 66889758
methyl (1-methylcycloheptyl) carbonate
CID 172553116
4-chloro-1-methoxy-1-methylcyclohexane
CID 174685185
bis[(1-methylcyclohexyl)oxy]borinic acid
CID 68895050
1,4-dimethoxy-4-methylpiperidine
CID 91124438
bis(1-methylcyclohexyl) oxalate
CID 154101354

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-1-methylcyclononane?
The IUPAC name of 1-methoxy-1-methylcyclononane (CID 123479365) is 1-methoxy-1-methylcyclononane.
What is the SMILES notation for 1-methoxy-1-methylcyclononane?
The canonical SMILES for 1-methoxy-1-methylcyclononane is COC1(C)CCCCCCCC1.
What is the InChIKey of 1-methoxy-1-methylcyclononane?
The InChIKey is XHKJRPQDRLKVIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-11(12-2)9-7-5-3-4-6-8-10-11/h3-10H2,1-2H3.
What are the key properties of 1-methoxy-1-methylcyclononane?
1-methoxy-1-methylcyclononane has a molecular weight of 170.30 g/mol, XLogP of 3.53, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-1-methylcyclononane is sourced from PubChem (CID 123479365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).