pent-4-enylcyclohexane

C11H20 — CID 523968

IUPACpent-4-enylcyclohexane
SMILESC=CCCCC1CCCCC1
InChIInChI=1S/C11H20/c1-2-3-5-8-11-9-6-4-7-10-11/h2,11H,1,3-10H2
InChIKeyCYCUXCSZQIHKAU-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.92
Rot. Bonds4

About pent-4-enylcyclohexane

pent-4-enylcyclohexane (PubChem CID 523968) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is pent-4-enylcyclohexane.

Molecular Properties

Compound Namepent-4-enylcyclohexane
PubChem CID523968
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Namepent-4-enylcyclohexane
SMILESC=CCCCC1CCCCC1
InChIInChI=1S/C11H20/c1-2-3-5-8-11-9-6-4-7-10-11/h2,11H,1,3-10H2
InChIKeyCYCUXCSZQIHKAU-UHFFFAOYSA-N
XLogP3.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,2,4-Trivinylcyclohexane
CID 96529
Vinylcyclohexane
CID 12757
Allylcyclohexane
CID 75027
Cyclohexane, 1-methylene-4-(1-methylethenyl)-
CID 68140
Cyclohexylallene
CID 21873
8-Methyldec-1-ene
CID 521957
4,6,8-Trimethyl-1-nonene
CID 41077
Cyclohexene, 3-propyl-
CID 138092
8-Methyl-1-undecene
CID 522552
7-Methyl-1-undecene
CID 522554
(Prop-1-en-2-yl)cyclohexane
CID 523966
1,2-Diethenylcyclohexane
CID 70491

Frequently Asked Questions

What is the IUPAC name of pent-4-enylcyclohexane?
The IUPAC name of pent-4-enylcyclohexane (CID 523968) is pent-4-enylcyclohexane.
What is the SMILES notation for pent-4-enylcyclohexane?
The canonical SMILES for pent-4-enylcyclohexane is C=CCCCC1CCCCC1.
What is the InChIKey of pent-4-enylcyclohexane?
The InChIKey is CYCUXCSZQIHKAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-2-3-5-8-11-9-6-4-7-10-11/h2,11H,1,3-10H2.
What are the key properties of pent-4-enylcyclohexane?
pent-4-enylcyclohexane has a molecular weight of 152.28 g/mol, XLogP of 3.92, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pent-4-enylcyclohexane is sourced from PubChem (CID 523968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).