3-(2-cyclopentylethoxy)propan-1-ol

C10H20O2 — CID 174164261

IUPAC3-(2-cyclopentylethoxy)propan-1-ol
SMILESOCCCOCCC1CCCC1
InChIInChI=1S/C10H20O2/c11-7-3-8-12-9-6-10-4-1-2-5-10/h10-11H,1-9H2
InChIKeyHMVLGHUECZOPCL-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.97
Rot. Bonds6

About 3-(2-cyclopentylethoxy)propan-1-ol

3-(2-cyclopentylethoxy)propan-1-ol (PubChem CID 174164261) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 3-(2-cyclopentylethoxy)propan-1-ol.

Molecular Properties

Compound Name3-(2-cyclopentylethoxy)propan-1-ol
PubChem CID174164261
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name3-(2-cyclopentylethoxy)propan-1-ol
SMILESOCCCOCCC1CCCC1
InChIInChI=1S/C10H20O2/c11-7-3-8-12-9-6-10-4-1-2-5-10/h10-11H,1-9H2
InChIKeyHMVLGHUECZOPCL-UHFFFAOYSA-N
XLogP1.97
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 104680589
2-[2-(cyclopentylmethoxy)ethoxy]ethanol
CID 59001866
2-amino-5-(2-cyclobutylethoxy)-2-ethylpentan-1-ol
CID 106206804
3-[4-[2-(2-chloroethoxy)ethyl]piperidin-1-yl]propan-1-ol
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CID 113362814

Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclopentylethoxy)propan-1-ol?
The IUPAC name of 3-(2-cyclopentylethoxy)propan-1-ol (CID 174164261) is 3-(2-cyclopentylethoxy)propan-1-ol.
What is the SMILES notation for 3-(2-cyclopentylethoxy)propan-1-ol?
The canonical SMILES for 3-(2-cyclopentylethoxy)propan-1-ol is OCCCOCCC1CCCC1.
What is the InChIKey of 3-(2-cyclopentylethoxy)propan-1-ol?
The InChIKey is HMVLGHUECZOPCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c11-7-3-8-12-9-6-10-4-1-2-5-10/h10-11H,1-9H2.
What are the key properties of 3-(2-cyclopentylethoxy)propan-1-ol?
3-(2-cyclopentylethoxy)propan-1-ol has a molecular weight of 172.27 g/mol, XLogP of 1.97, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclopentylethoxy)propan-1-ol is sourced from PubChem (CID 174164261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).