1-cyclopentylhex-5-en-3-ol

C11H20O — CID 115778851

IUPAC1-cyclopentylhex-5-en-3-ol
SMILESC=CCC(O)CCC1CCCC1
InChIInChI=1S/C11H20O/c1-2-5-11(12)9-8-10-6-3-4-7-10/h2,10-12H,1,3-9H2
InChIKeyDADXJKNKIVEXSI-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.89
Rot. Bonds5

About 1-cyclopentylhex-5-en-3-ol

1-cyclopentylhex-5-en-3-ol (PubChem CID 115778851) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-cyclopentylhex-5-en-3-ol.

Molecular Properties

Compound Name1-cyclopentylhex-5-en-3-ol
PubChem CID115778851
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name1-cyclopentylhex-5-en-3-ol
SMILESC=CCC(O)CCC1CCCC1
InChIInChI=1S/C11H20O/c1-2-5-11(12)9-8-10-6-3-4-7-10/h2,10-12H,1,3-9H2
InChIKeyDADXJKNKIVEXSI-UHFFFAOYSA-N
XLogP2.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
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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Related Compounds

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CID 65184761
1-cyclohexyl-6-methylhept-6-en-3-ol
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1-cyclopentyldecan-3-ol
CID 115783211
4-cyclohexyl-1-cyclohexylsulfanylbutan-2-ol
CID 57068108
1-cyclopentyloct-6-yn-3-ol
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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentylhex-5-en-3-ol?
The IUPAC name of 1-cyclopentylhex-5-en-3-ol (CID 115778851) is 1-cyclopentylhex-5-en-3-ol.
What is the SMILES notation for 1-cyclopentylhex-5-en-3-ol?
The canonical SMILES for 1-cyclopentylhex-5-en-3-ol is C=CCC(O)CCC1CCCC1.
What is the InChIKey of 1-cyclopentylhex-5-en-3-ol?
The InChIKey is DADXJKNKIVEXSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-2-5-11(12)9-8-10-6-3-4-7-10/h2,10-12H,1,3-9H2.
What are the key properties of 1-cyclopentylhex-5-en-3-ol?
1-cyclopentylhex-5-en-3-ol has a molecular weight of 168.28 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylhex-5-en-3-ol is sourced from PubChem (CID 115778851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).