cyclopenta-1,3-dien-1-ylcyclohexane

C11H16 — CID 12531744

IUPACcyclopenta-1,3-dien-1-ylcyclohexane
SMILESC1=CCC(C2CCCCC2)=C1
InChIInChI=1S/C11H16/c1-2-6-10(7-3-1)11-8-4-5-9-11/h4-5,8,10H,1-3,6-7,9H2
InChIKeyAQHXALDLCNTRII-UHFFFAOYSA-N
MW148.25 g/mol
LogP3.45
Rot. Bonds1

About cyclopenta-1,3-dien-1-ylcyclohexane

cyclopenta-1,3-dien-1-ylcyclohexane (PubChem CID 12531744) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is cyclopenta-1,3-dien-1-ylcyclohexane.

Molecular Properties

Compound Namecyclopenta-1,3-dien-1-ylcyclohexane
PubChem CID12531744
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Namecyclopenta-1,3-dien-1-ylcyclohexane
SMILESC1=CCC(C2CCCCC2)=C1
InChIInChI=1S/C11H16/c1-2-6-10(7-3-1)11-8-4-5-9-11/h4-5,8,10H,1-3,6-7,9H2
InChIKeyAQHXALDLCNTRII-UHFFFAOYSA-N
XLogP3.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Beta-Phellandrene
CID 11142
(-)-beta-Phellandrene
CID 443161
d-beta-Phellandrene
CID 442484
Sesquiphellandrene
CID 519764
Alpha-Zingiberene
CID 11127403
2-Methyl-5-(6-methylhept-5-en-2-yl)cyclohexa-1,3-diene
CID 521253
(-)-Zingiberene
CID 92776
gamma-Curcumene
CID 12304273
beta-Sesquiphellandrene
CID 12315492
(+)-beta-Sesquiphellandrene
CID 11106487
p-Mentha-3,8-diene
CID 521851
7-Epizingiberene
CID 21729595

Frequently Asked Questions

What is the IUPAC name of cyclopenta-1,3-dien-1-ylcyclohexane?
The IUPAC name of cyclopenta-1,3-dien-1-ylcyclohexane (CID 12531744) is cyclopenta-1,3-dien-1-ylcyclohexane.
What is the SMILES notation for cyclopenta-1,3-dien-1-ylcyclohexane?
The canonical SMILES for cyclopenta-1,3-dien-1-ylcyclohexane is C1=CCC(C2CCCCC2)=C1.
What is the InChIKey of cyclopenta-1,3-dien-1-ylcyclohexane?
The InChIKey is AQHXALDLCNTRII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16/c1-2-6-10(7-3-1)11-8-4-5-9-11/h4-5,8,10H,1-3,6-7,9H2.
What are the key properties of cyclopenta-1,3-dien-1-ylcyclohexane?
cyclopenta-1,3-dien-1-ylcyclohexane has a molecular weight of 148.25 g/mol, XLogP of 3.45, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-dien-1-ylcyclohexane is sourced from PubChem (CID 12531744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).