cyclohexane;methylcyclopentane

C12H24 — CID 20788572

IUPACcyclohexane;methylcyclopentane
SMILESC1CCCCC1.CC1CCCC1
InChIInChI=1S/2C6H12/c1-6-4-2-3-5-6;1-2-4-6-5-3-1/h6H,2-5H2,1H3;1-6H2
InChIKeyISUUFJFPSXCANV-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.54
Rot. Bonds

About cyclohexane;methylcyclopentane

cyclohexane;methylcyclopentane (PubChem CID 20788572) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is cyclohexane;methylcyclopentane.

Molecular Properties

Compound Namecyclohexane;methylcyclopentane
PubChem CID20788572
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Namecyclohexane;methylcyclopentane
SMILESC1CCCCC1.CC1CCCC1
InChIInChI=1S/2C6H12/c1-6-4-2-3-5-6;1-2-4-6-5-3-1/h6H,2-5H2,1H3;1-6H2
InChIKeyISUUFJFPSXCANV-UHFFFAOYSA-N
XLogP4.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of cyclohexane;methylcyclopentane?
The IUPAC name of cyclohexane;methylcyclopentane (CID 20788572) is cyclohexane;methylcyclopentane.
What is the SMILES notation for cyclohexane;methylcyclopentane?
The canonical SMILES for cyclohexane;methylcyclopentane is C1CCCCC1.CC1CCCC1.
What is the InChIKey of cyclohexane;methylcyclopentane?
The InChIKey is ISUUFJFPSXCANV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H12/c1-6-4-2-3-5-6;1-2-4-6-5-3-1/h6H,2-5H2,1H3;1-6H2.
What are the key properties of cyclohexane;methylcyclopentane?
cyclohexane;methylcyclopentane has a molecular weight of 168.32 g/mol, XLogP of 4.54, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexane;methylcyclopentane is sourced from PubChem (CID 20788572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).