1-cyclopropylidene-4-propan-2-ylcyclohexane

C12H20 — CID 143970565

IUPAC1-cyclopropylidene-4-propan-2-ylcyclohexane
SMILESCC(C)C1CCC(=C2CC2)CC1
InChIInChI=1S/C12H20/c1-9(2)10-3-5-11(6-4-10)12-7-8-12/h9-10H,3-8H2,1-2H3
InChIKeyICHJCUHENSPVKE-UHFFFAOYSA-N
MW164.29 g/mol
LogP3.92
Rot. Bonds1

About 1-cyclopropylidene-4-propan-2-ylcyclohexane

1-cyclopropylidene-4-propan-2-ylcyclohexane (PubChem CID 143970565) has the molecular formula C12H20 and a molecular weight of 164.29 g/mol. Its IUPAC name is 1-cyclopropylidene-4-propan-2-ylcyclohexane.

Molecular Properties

Compound Name1-cyclopropylidene-4-propan-2-ylcyclohexane
PubChem CID143970565
Molecular FormulaC12H20
Molecular Weight164.29 g/mol
Exact Mass164.16
IUPAC Name1-cyclopropylidene-4-propan-2-ylcyclohexane
SMILESCC(C)C1CCC(=C2CC2)CC1
InChIInChI=1S/C12H20/c1-9(2)10-3-5-11(6-4-10)12-7-8-12/h9-10H,3-8H2,1-2H3
InChIKeyICHJCUHENSPVKE-UHFFFAOYSA-N
XLogP3.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.29
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

p-Menth-4(8)-ene
CID 517975
m-Menth-3(8)-ene
CID 518828
7-(1-Methylethylidene)bicyclo(4.1.0)heptane
CID 40707
1-Menthene
CID 25445
trans-(1S,2S)-1,2-diethyl-4-propan-2-ylidenecyclohexane
CID 162882634
(3S,4aR,5R)-3,8-dimethyl-5-propan-2-yl-1,2,3,4,4a,5,6,7-octahydronaphthalene
CID 163050319
1,2,3-Trimethylcyclohex-1-ene
CID 12537123
4-Methyl-3-carene
CID 14029516
1-Tert-butyl-4-isopropylidene-cyclohexane
CID 4429565
1,3,3-Trimethyl-2-(2-methyl-cyclopropyl)-cyclohexene
CID 595941
1-tert-Butyl-4-cyclopropylidenecyclohexane
CID 13280445
Tetramethyloctene
CID 18915868

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylidene-4-propan-2-ylcyclohexane?
The IUPAC name of 1-cyclopropylidene-4-propan-2-ylcyclohexane (CID 143970565) is 1-cyclopropylidene-4-propan-2-ylcyclohexane.
What is the SMILES notation for 1-cyclopropylidene-4-propan-2-ylcyclohexane?
The canonical SMILES for 1-cyclopropylidene-4-propan-2-ylcyclohexane is CC(C)C1CCC(=C2CC2)CC1.
What is the InChIKey of 1-cyclopropylidene-4-propan-2-ylcyclohexane?
The InChIKey is ICHJCUHENSPVKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20/c1-9(2)10-3-5-11(6-4-10)12-7-8-12/h9-10H,3-8H2,1-2H3.
What are the key properties of 1-cyclopropylidene-4-propan-2-ylcyclohexane?
1-cyclopropylidene-4-propan-2-ylcyclohexane has a molecular weight of 164.29 g/mol, XLogP of 3.92, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropylidene-4-propan-2-ylcyclohexane is sourced from PubChem (CID 143970565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).