2-(2-butylcyclopentyl)oxyethanol

C11H22O2 — CID 58242172

IUPAC2-(2-butylcyclopentyl)oxyethanol
SMILESCCCCC1CCCC1OCCO
InChIInChI=1S/C11H22O2/c1-2-3-5-10-6-4-7-11(10)13-9-8-12/h10-12H,2-9H2,1H3
InChIKeyWNUKOLHOLSHESV-UHFFFAOYSA-N
MW186.29 g/mol
LogP2.35
Rot. Bonds6

About 2-(2-butylcyclopentyl)oxyethanol

2-(2-butylcyclopentyl)oxyethanol (PubChem CID 58242172) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 2-(2-butylcyclopentyl)oxyethanol.

Molecular Properties

Compound Name2-(2-butylcyclopentyl)oxyethanol
PubChem CID58242172
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name2-(2-butylcyclopentyl)oxyethanol
SMILESCCCCC1CCCC1OCCO
InChIInChI=1S/C11H22O2/c1-2-3-5-10-6-4-7-11(10)13-9-8-12/h10-12H,2-9H2,1H3
InChIKeyWNUKOLHOLSHESV-UHFFFAOYSA-N
XLogP2.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-butylcyclopentyl)oxyethanol?
The IUPAC name of 2-(2-butylcyclopentyl)oxyethanol (CID 58242172) is 2-(2-butylcyclopentyl)oxyethanol.
What is the SMILES notation for 2-(2-butylcyclopentyl)oxyethanol?
The canonical SMILES for 2-(2-butylcyclopentyl)oxyethanol is CCCCC1CCCC1OCCO.
What is the InChIKey of 2-(2-butylcyclopentyl)oxyethanol?
The InChIKey is WNUKOLHOLSHESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-2-3-5-10-6-4-7-11(10)13-9-8-12/h10-12H,2-9H2,1H3.
What are the key properties of 2-(2-butylcyclopentyl)oxyethanol?
2-(2-butylcyclopentyl)oxyethanol has a molecular weight of 186.29 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butylcyclopentyl)oxyethanol is sourced from PubChem (CID 58242172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).