4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol

C20H34O — CID 129083161

IUPAC4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol
SMILESOC1CCC(C=C(C2CCCCC2)C2CCCCC2)CC1
InChIInChI=1S/C20H34O/c21-19-13-11-16(12-14-19)15-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h15-19,21H,1-14H2
InChIKeyLIRFZFIHQJYHMR-UHFFFAOYSA-N
MW290.49 g/mol
LogP5.62
Rot. Bonds3

About 4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol

4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol (PubChem CID 129083161) has the molecular formula C20H34O and a molecular weight of 290.49 g/mol. Its IUPAC name is 4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol
PubChem CID129083161
Molecular FormulaC20H34O
Molecular Weight290.49 g/mol
Exact Mass290.26
IUPAC Name4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol
SMILESOC1CCC(C=C(C2CCCCC2)C2CCCCC2)CC1
InChIInChI=1S/C20H34O/c21-19-13-11-16(12-14-19)15-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h15-19,21H,1-14H2
InChIKeyLIRFZFIHQJYHMR-UHFFFAOYSA-N
XLogP5.62
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.49
LogP ≤ 55.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-hydroxycyclododecane-1-carboxylic acid
CID 23321574
9-(3,4-dicyclohexylcyclohexyl)-10-[10-[4-(2,2-dicyclohexylethenyl)cyclohexyl]-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracen-9-yl]-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracene
CID 140562346
3-(2,2-dicyclohexylethenyl)-9,9-dimethyl-9-azoniabicyclo[3.3.1]nonane
CID 68941000
cyclohexanol;cyclooctanol
CID 22461579
5-hydroxycyclononane-1-carbaldehyde
CID 90716773
cyclohexanol;iron
CID 146901686
tetrakis(cyclooctanol);zirconium
CID 142301923
cyclohexanol;gallane
CID 172997547
cyclohexane-1,4-diol
CID 11162
cyclohexanol;dicyclohexylmethanone
CID 174532304
CID 157040931
CID 157040931
cyclohexanol;methanol
CID 18353815

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol?
The IUPAC name of 4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol (CID 129083161) is 4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol.
What is the SMILES notation for 4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol?
The canonical SMILES for 4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol is OC1CCC(C=C(C2CCCCC2)C2CCCCC2)CC1.
What is the InChIKey of 4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol?
The InChIKey is LIRFZFIHQJYHMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34O/c21-19-13-11-16(12-14-19)15-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h15-19,21H,1-14H2.
What are the key properties of 4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol?
4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol has a molecular weight of 290.49 g/mol, XLogP of 5.62, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dicyclohexylethenyl)cyclohexan-1-ol is sourced from PubChem (CID 129083161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).