1-(3-ethylcyclopentyl)but-3-en-1-ol

C11H20O — CID 65409759

IUPAC1-(3-ethylcyclopentyl)but-3-en-1-ol
SMILESC=CCC(O)C1CCC(CC)C1
InChIInChI=1S/C11H20O/c1-3-5-11(12)10-7-6-9(4-2)8-10/h3,9-12H,1,4-8H2,2H3
InChIKeyZEZOULHZEIQTNL-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.75
Rot. Bonds4

About 1-(3-ethylcyclopentyl)but-3-en-1-ol

1-(3-ethylcyclopentyl)but-3-en-1-ol (PubChem CID 65409759) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-(3-ethylcyclopentyl)but-3-en-1-ol.

Molecular Properties

Compound Name1-(3-ethylcyclopentyl)but-3-en-1-ol
PubChem CID65409759
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name1-(3-ethylcyclopentyl)but-3-en-1-ol
SMILESC=CCC(O)C1CCC(CC)C1
InChIInChI=1S/C11H20O/c1-3-5-11(12)10-7-6-9(4-2)8-10/h3,9-12H,1,4-8H2,2H3
InChIKeyZEZOULHZEIQTNL-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

cyclopropyl-(3-ethylcyclopentyl)methanol
CID 65411720
2-cyclobutyl-1-(3-ethylcyclohexyl)ethanol
CID 65457880
1-(4-ethylcyclohexyl)pent-4-en-1-ol
CID 65392687
1-(3-bicyclo[3.1.0]hexanyl)but-3-en-1-ol
CID 115778669
cyclopentyl-(3-ethylcyclopentyl)methanol
CID 65410347
1-(3-ethylcyclohexyl)-2-(thian-4-yl)ethanol
CID 105104403
1-(4-ethylcyclohexyl)-2,2-dimethylpropan-1-ol
CID 64748582
1-(3-ethylcyclopentyl)hex-5-en-1-amine
CID 65411985
2-(3,3-difluorocyclohexyl)-1-(3-ethylcyclopentyl)ethanol
CID 114224702
2,2-dicyclopropyl-1-(4-ethylcyclohexyl)ethanol
CID 112743634
1-(3-ethylcyclopentyl)-2,2-dimethylpropan-1-amine
CID 65411012
1-(3-ethylcyclohexyl)-3-methylbut-3-en-1-ol
CID 79177597

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylcyclopentyl)but-3-en-1-ol?
The IUPAC name of 1-(3-ethylcyclopentyl)but-3-en-1-ol (CID 65409759) is 1-(3-ethylcyclopentyl)but-3-en-1-ol.
What is the SMILES notation for 1-(3-ethylcyclopentyl)but-3-en-1-ol?
The canonical SMILES for 1-(3-ethylcyclopentyl)but-3-en-1-ol is C=CCC(O)C1CCC(CC)C1.
What is the InChIKey of 1-(3-ethylcyclopentyl)but-3-en-1-ol?
The InChIKey is ZEZOULHZEIQTNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-3-5-11(12)10-7-6-9(4-2)8-10/h3,9-12H,1,4-8H2,2H3.
What are the key properties of 1-(3-ethylcyclopentyl)but-3-en-1-ol?
1-(3-ethylcyclopentyl)but-3-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 1-(3-ethylcyclopentyl)but-3-en-1-ol is sourced from PubChem (CID 65409759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).