2-cyclopropylidene-1,4-dimethylcyclohexane

C11H18 — CID 54012682

IUPAC2-cyclopropylidene-1,4-dimethylcyclohexane
SMILESCC1CCC(C)C(=C2CC2)C1
InChIInChI=1S/C11H18/c1-8-3-4-9(2)11(7-8)10-5-6-10/h8-9H,3-7H2,1-2H3
InChIKeyKTLXYWJBPZEOEH-UHFFFAOYSA-N
MW150.27 g/mol
LogP3.53
Rot. Bonds

About 2-cyclopropylidene-1,4-dimethylcyclohexane

2-cyclopropylidene-1,4-dimethylcyclohexane (PubChem CID 54012682) has the molecular formula C11H18 and a molecular weight of 150.27 g/mol. Its IUPAC name is 2-cyclopropylidene-1,4-dimethylcyclohexane.

Molecular Properties

Compound Name2-cyclopropylidene-1,4-dimethylcyclohexane
PubChem CID54012682
Molecular FormulaC11H18
Molecular Weight150.27 g/mol
Exact Mass150.14
IUPAC Name2-cyclopropylidene-1,4-dimethylcyclohexane
SMILESCC1CCC(C)C(=C2CC2)C1
InChIInChI=1S/C11H18/c1-8-3-4-9(2)11(7-8)10-5-6-10/h8-9H,3-7H2,1-2H3
InChIKeyKTLXYWJBPZEOEH-UHFFFAOYSA-N
XLogP3.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.27
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropylidene-1,4-dimethylcyclohexane?
The IUPAC name of 2-cyclopropylidene-1,4-dimethylcyclohexane (CID 54012682) is 2-cyclopropylidene-1,4-dimethylcyclohexane.
What is the SMILES notation for 2-cyclopropylidene-1,4-dimethylcyclohexane?
The canonical SMILES for 2-cyclopropylidene-1,4-dimethylcyclohexane is CC1CCC(C)C(=C2CC2)C1.
What is the InChIKey of 2-cyclopropylidene-1,4-dimethylcyclohexane?
The InChIKey is KTLXYWJBPZEOEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-8-3-4-9(2)11(7-8)10-5-6-10/h8-9H,3-7H2,1-2H3.
What are the key properties of 2-cyclopropylidene-1,4-dimethylcyclohexane?
2-cyclopropylidene-1,4-dimethylcyclohexane has a molecular weight of 150.27 g/mol, XLogP of 3.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylidene-1,4-dimethylcyclohexane is sourced from PubChem (CID 54012682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).