4-pent-1-enylcyclohexan-1-ol

C11H20O — CID 54384714

IUPAC4-pent-1-enylcyclohexan-1-ol
SMILESCCCC=CC1CCC(O)CC1
InChIInChI=1S/C11H20O/c1-2-3-4-5-10-6-8-11(12)9-7-10/h4-5,10-12H,2-3,6-9H2,1H3
InChIKeyVCKGSFQIXDKQOL-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.89
Rot. Bonds3

About 4-pent-1-enylcyclohexan-1-ol

4-pent-1-enylcyclohexan-1-ol (PubChem CID 54384714) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 4-pent-1-enylcyclohexan-1-ol.

Molecular Properties

Compound Name4-pent-1-enylcyclohexan-1-ol
PubChem CID54384714
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name4-pent-1-enylcyclohexan-1-ol
SMILESCCCC=CC1CCC(O)CC1
InChIInChI=1S/C11H20O/c1-2-3-4-5-10-6-8-11(12)9-7-10/h4-5,10-12H,2-3,6-9H2,1H3
InChIKeyVCKGSFQIXDKQOL-UHFFFAOYSA-N
XLogP2.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-pent-1-enylcyclohexan-1-ol?
The IUPAC name of 4-pent-1-enylcyclohexan-1-ol (CID 54384714) is 4-pent-1-enylcyclohexan-1-ol.
What is the SMILES notation for 4-pent-1-enylcyclohexan-1-ol?
The canonical SMILES for 4-pent-1-enylcyclohexan-1-ol is CCCC=CC1CCC(O)CC1.
What is the InChIKey of 4-pent-1-enylcyclohexan-1-ol?
The InChIKey is VCKGSFQIXDKQOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-2-3-4-5-10-6-8-11(12)9-7-10/h4-5,10-12H,2-3,6-9H2,1H3.
What are the key properties of 4-pent-1-enylcyclohexan-1-ol?
4-pent-1-enylcyclohexan-1-ol has a molecular weight of 168.28 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pent-1-enylcyclohexan-1-ol is sourced from PubChem (CID 54384714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).