2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol

C13H26N2O — CID 45222775

IUPAC2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol
SMILESCCN1CCN(C2CCCC2)C(CCO)C1
InChIInChI=1S/C13H26N2O/c1-2-14-8-9-15(12-5-3-4-6-12)13(11-14)7-10-16/h12-13,16H,2-11H2,1H3
InChIKeyXUMYDYMEIPNOFK-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.32
Rot. Bonds4

About 2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol

2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol (PubChem CID 45222775) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol.

Molecular Properties

Compound Name2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol
PubChem CID45222775
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol
SMILESCCN1CCN(C2CCCC2)C(CCO)C1
InChIInChI=1S/C13H26N2O/c1-2-14-8-9-15(12-5-3-4-6-12)13(11-14)7-10-16/h12-13,16H,2-11H2,1H3
InChIKeyXUMYDYMEIPNOFK-UHFFFAOYSA-N
XLogP1.32
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol?
The IUPAC name of 2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol (CID 45222775) is 2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol.
What is the SMILES notation for 2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol?
The canonical SMILES for 2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol is CCN1CCN(C2CCCC2)C(CCO)C1.
What is the InChIKey of 2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol?
The InChIKey is XUMYDYMEIPNOFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-2-14-8-9-15(12-5-3-4-6-12)13(11-14)7-10-16/h12-13,16H,2-11H2,1H3.
What are the key properties of 2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol?
2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol has a molecular weight of 226.36 g/mol, XLogP of 1.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentyl-4-ethylpiperazin-2-yl)ethanol is sourced from PubChem (CID 45222775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).