2-[2-(cyclopentylmethoxy)ethoxy]ethanol

C10H20O3 — CID 59001866

IUPAC2-[2-(cyclopentylmethoxy)ethoxy]ethanol
SMILESOCCOCCOCC1CCCC1
InChIInChI=1S/C10H20O3/c11-5-6-12-7-8-13-9-10-3-1-2-4-10/h10-11H,1-9H2
InChIKeyKHWAGECQZICZFK-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.20
Rot. Bonds7

About 2-[2-(cyclopentylmethoxy)ethoxy]ethanol

2-[2-(cyclopentylmethoxy)ethoxy]ethanol (PubChem CID 59001866) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-[2-(cyclopentylmethoxy)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(cyclopentylmethoxy)ethoxy]ethanol
PubChem CID59001866
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name2-[2-(cyclopentylmethoxy)ethoxy]ethanol
SMILESOCCOCCOCC1CCCC1
InChIInChI=1S/C10H20O3/c11-5-6-12-7-8-13-9-10-3-1-2-4-10/h10-11H,1-9H2
InChIKeyKHWAGECQZICZFK-UHFFFAOYSA-N
XLogP1.20
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopentylmethoxy)ethoxy]ethanol?
The IUPAC name of 2-[2-(cyclopentylmethoxy)ethoxy]ethanol (CID 59001866) is 2-[2-(cyclopentylmethoxy)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(cyclopentylmethoxy)ethoxy]ethanol?
The canonical SMILES for 2-[2-(cyclopentylmethoxy)ethoxy]ethanol is OCCOCCOCC1CCCC1.
What is the InChIKey of 2-[2-(cyclopentylmethoxy)ethoxy]ethanol?
The InChIKey is KHWAGECQZICZFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c11-5-6-12-7-8-13-9-10-3-1-2-4-10/h10-11H,1-9H2.
What are the key properties of 2-[2-(cyclopentylmethoxy)ethoxy]ethanol?
2-[2-(cyclopentylmethoxy)ethoxy]ethanol has a molecular weight of 188.27 g/mol, XLogP of 1.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopentylmethoxy)ethoxy]ethanol is sourced from PubChem (CID 59001866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).