11,11-dimethylbicyclo[4.4.1]undecane

C13H24 — CID 71443320

IUPAC11,11-dimethylbicyclo[4.4.1]undecane
SMILESCC1(C)C2CCCCC1CCCC2
InChIInChI=1S/C13H24/c1-13(2)11-7-3-4-8-12(13)10-6-5-9-11/h11-12H,3-10H2,1-2H3
InChIKeyOVXIPNHJQJQNDO-UHFFFAOYSA-N
MW180.33 g/mol
LogP4.39
Rot. Bonds

About 11,11-dimethylbicyclo[4.4.1]undecane

11,11-dimethylbicyclo[4.4.1]undecane (PubChem CID 71443320) has the molecular formula C13H24 and a molecular weight of 180.33 g/mol. Its IUPAC name is 11,11-dimethylbicyclo[4.4.1]undecane.

Molecular Properties

Compound Name11,11-dimethylbicyclo[4.4.1]undecane
PubChem CID71443320
Molecular FormulaC13H24
Molecular Weight180.33 g/mol
Exact Mass180.19
IUPAC Name11,11-dimethylbicyclo[4.4.1]undecane
SMILESCC1(C)C2CCCCC1CCCC2
InChIInChI=1S/C13H24/c1-13(2)11-7-3-4-8-12(13)10-6-5-9-11/h11-12H,3-10H2,1-2H3
InChIKeyOVXIPNHJQJQNDO-UHFFFAOYSA-N
XLogP4.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.33
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 11,11-dimethylbicyclo[4.4.1]undecane?
The IUPAC name of 11,11-dimethylbicyclo[4.4.1]undecane (CID 71443320) is 11,11-dimethylbicyclo[4.4.1]undecane.
What is the SMILES notation for 11,11-dimethylbicyclo[4.4.1]undecane?
The canonical SMILES for 11,11-dimethylbicyclo[4.4.1]undecane is CC1(C)C2CCCCC1CCCC2.
What is the InChIKey of 11,11-dimethylbicyclo[4.4.1]undecane?
The InChIKey is OVXIPNHJQJQNDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24/c1-13(2)11-7-3-4-8-12(13)10-6-5-9-11/h11-12H,3-10H2,1-2H3.
What are the key properties of 11,11-dimethylbicyclo[4.4.1]undecane?
11,11-dimethylbicyclo[4.4.1]undecane has a molecular weight of 180.33 g/mol, XLogP of 4.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-dimethylbicyclo[4.4.1]undecane is sourced from PubChem (CID 71443320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).