2-cyclohexylpent-4-en-1-ol

C11H20O — CID 77257118

IUPAC2-cyclohexylpent-4-en-1-ol
SMILESC=CCC(CO)C1CCCCC1
InChIInChI=1S/C11H20O/c1-2-6-11(9-12)10-7-4-3-5-8-10/h2,10-12H,1,3-9H2
InChIKeyUFBOQEMEUIGSPP-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.75
Rot. Bonds4

About 2-cyclohexylpent-4-en-1-ol

2-cyclohexylpent-4-en-1-ol (PubChem CID 77257118) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-cyclohexylpent-4-en-1-ol.

Molecular Properties

Compound Name2-cyclohexylpent-4-en-1-ol
PubChem CID77257118
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name2-cyclohexylpent-4-en-1-ol
SMILESC=CCC(CO)C1CCCCC1
InChIInChI=1S/C11H20O/c1-2-6-11(9-12)10-7-4-3-5-8-10/h2,10-12H,1,3-9H2
InChIKeyUFBOQEMEUIGSPP-UHFFFAOYSA-N
XLogP2.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.75
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

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(2S)-2-cyclooctylbutan-1-ol
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[(1R)-1-prop-2-enoxybut-3-enyl]cyclohexane
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[(3S)-hex-5-en-1-yn-3-yl]cyclohexane
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(1R)-1-cyclohexylethane-1,2-diol
CID 11789331
1-cycloheptylhex-5-en-1-ol
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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylpent-4-en-1-ol?
The IUPAC name of 2-cyclohexylpent-4-en-1-ol (CID 77257118) is 2-cyclohexylpent-4-en-1-ol.
What is the SMILES notation for 2-cyclohexylpent-4-en-1-ol?
The canonical SMILES for 2-cyclohexylpent-4-en-1-ol is C=CCC(CO)C1CCCCC1.
What is the InChIKey of 2-cyclohexylpent-4-en-1-ol?
The InChIKey is UFBOQEMEUIGSPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-2-6-11(9-12)10-7-4-3-5-8-10/h2,10-12H,1,3-9H2.
What are the key properties of 2-cyclohexylpent-4-en-1-ol?
2-cyclohexylpent-4-en-1-ol has a molecular weight of 168.28 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylpent-4-en-1-ol is sourced from PubChem (CID 77257118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).