cyclopenta-2,4-dien-1-ylidenemethylcyclohexane

C12H16 — CID 13250204

IUPACcyclopenta-2,4-dien-1-ylidenemethylcyclohexane
SMILESC1=CC(=CC2CCCCC2)C=C1
InChIInChI=1S/C12H16/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h4-5,8-11H,1-3,6-7H2
InChIKeyJZLAYHCMSHSZKE-UHFFFAOYSA-N
MW160.26 g/mol
LogP3.62
Rot. Bonds1

About cyclopenta-2,4-dien-1-ylidenemethylcyclohexane

cyclopenta-2,4-dien-1-ylidenemethylcyclohexane (PubChem CID 13250204) has the molecular formula C12H16 and a molecular weight of 160.26 g/mol. Its IUPAC name is cyclopenta-2,4-dien-1-ylidenemethylcyclohexane.

Molecular Properties

Compound Namecyclopenta-2,4-dien-1-ylidenemethylcyclohexane
PubChem CID13250204
Molecular FormulaC12H16
Molecular Weight160.26 g/mol
Exact Mass160.13
IUPAC Namecyclopenta-2,4-dien-1-ylidenemethylcyclohexane
SMILESC1=CC(=CC2CCCCC2)C=C1
InChIInChI=1S/C12H16/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h4-5,8-11H,1-3,6-7H2
InChIKeyJZLAYHCMSHSZKE-UHFFFAOYSA-N
XLogP3.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of cyclopenta-2,4-dien-1-ylidenemethylcyclohexane?
The IUPAC name of cyclopenta-2,4-dien-1-ylidenemethylcyclohexane (CID 13250204) is cyclopenta-2,4-dien-1-ylidenemethylcyclohexane.
What is the SMILES notation for cyclopenta-2,4-dien-1-ylidenemethylcyclohexane?
The canonical SMILES for cyclopenta-2,4-dien-1-ylidenemethylcyclohexane is C1=CC(=CC2CCCCC2)C=C1.
What is the InChIKey of cyclopenta-2,4-dien-1-ylidenemethylcyclohexane?
The InChIKey is JZLAYHCMSHSZKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h4-5,8-11H,1-3,6-7H2.
What are the key properties of cyclopenta-2,4-dien-1-ylidenemethylcyclohexane?
cyclopenta-2,4-dien-1-ylidenemethylcyclohexane has a molecular weight of 160.26 g/mol, XLogP of 3.62, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-2,4-dien-1-ylidenemethylcyclohexane is sourced from PubChem (CID 13250204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).