(1R)-1-methylbicyclo[4.3.2]undecane

C12H22 — CID 177097651

IUPAC(1R)-1-methylbicyclo[4.3.2]undecane
SMILESC[C@@]12CCCCC(CCC1)CC2
InChIInChI=1S/C12H22/c1-12-8-3-2-5-11(7-10-12)6-4-9-12/h11H,2-10H2,1H3/t11?,12-/m1/s1
InChIKeyOYBXNCXOUCJCFQ-PIJUOVFKSA-N
MW166.31 g/mol
LogP4.15
Rot. Bonds

About (1R)-1-methylbicyclo[4.3.2]undecane

(1R)-1-methylbicyclo[4.3.2]undecane (PubChem CID 177097651) has the molecular formula C12H22 and a molecular weight of 166.31 g/mol. Its IUPAC name is (1R)-1-methylbicyclo[4.3.2]undecane.

Molecular Properties

Compound Name(1R)-1-methylbicyclo[4.3.2]undecane
PubChem CID177097651
Molecular FormulaC12H22
Molecular Weight166.31 g/mol
Exact Mass166.17
IUPAC Name(1R)-1-methylbicyclo[4.3.2]undecane
SMILESC[C@@]12CCCCC(CCC1)CC2
InChIInChI=1S/C12H22/c1-12-8-3-2-5-11(7-10-12)6-4-9-12/h11H,2-10H2,1H3/t11?,12-/m1/s1
InChIKeyOYBXNCXOUCJCFQ-PIJUOVFKSA-N
XLogP4.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.31
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-methylbicyclo[4.3.2]undecane?
The IUPAC name of (1R)-1-methylbicyclo[4.3.2]undecane (CID 177097651) is (1R)-1-methylbicyclo[4.3.2]undecane.
What is the SMILES notation for (1R)-1-methylbicyclo[4.3.2]undecane?
The canonical SMILES for (1R)-1-methylbicyclo[4.3.2]undecane is C[C@@]12CCCCC(CCC1)CC2.
What is the InChIKey of (1R)-1-methylbicyclo[4.3.2]undecane?
The InChIKey is OYBXNCXOUCJCFQ-PIJUOVFKSA-N. The full InChI is InChI=1S/C12H22/c1-12-8-3-2-5-11(7-10-12)6-4-9-12/h11H,2-10H2,1H3/t11?,12-/m1/s1.
What are the key properties of (1R)-1-methylbicyclo[4.3.2]undecane?
(1R)-1-methylbicyclo[4.3.2]undecane has a molecular weight of 166.31 g/mol, XLogP of 4.15, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-methylbicyclo[4.3.2]undecane is sourced from PubChem (CID 177097651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).