2-(4-piperidin-4-ylpiperazin-1-yl)ethanol

C11H23N3O — CID 3831073

IUPAC2-(4-piperidin-4-ylpiperazin-1-yl)ethanol
SMILESOCCN1CCN(C2CCNCC2)CC1
InChIInChI=1S/C11H23N3O/c15-10-9-13-5-7-14(8-6-13)11-1-3-12-4-2-11/h11-12,15H,1-10H2
InChIKeyYNGKKJBRHMCKAO-UHFFFAOYSA-N
MW213.32 g/mol
LogP-0.65
Rot. Bonds3

About 2-(4-piperidin-4-ylpiperazin-1-yl)ethanol

2-(4-piperidin-4-ylpiperazin-1-yl)ethanol (PubChem CID 3831073) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-(4-piperidin-4-ylpiperazin-1-yl)ethanol.

Molecular Properties

Compound Name2-(4-piperidin-4-ylpiperazin-1-yl)ethanol
PubChem CID3831073
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name2-(4-piperidin-4-ylpiperazin-1-yl)ethanol
SMILESOCCN1CCN(C2CCNCC2)CC1
InChIInChI=1S/C11H23N3O/c15-10-9-13-5-7-14(8-6-13)11-1-3-12-4-2-11/h11-12,15H,1-10H2
InChIKeyYNGKKJBRHMCKAO-UHFFFAOYSA-N
XLogP-0.65
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-piperidin-4-ylpiperazin-1-yl)ethanol?
The IUPAC name of 2-(4-piperidin-4-ylpiperazin-1-yl)ethanol (CID 3831073) is 2-(4-piperidin-4-ylpiperazin-1-yl)ethanol.
What is the SMILES notation for 2-(4-piperidin-4-ylpiperazin-1-yl)ethanol?
The canonical SMILES for 2-(4-piperidin-4-ylpiperazin-1-yl)ethanol is OCCN1CCN(C2CCNCC2)CC1.
What is the InChIKey of 2-(4-piperidin-4-ylpiperazin-1-yl)ethanol?
The InChIKey is YNGKKJBRHMCKAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c15-10-9-13-5-7-14(8-6-13)11-1-3-12-4-2-11/h11-12,15H,1-10H2.
What are the key properties of 2-(4-piperidin-4-ylpiperazin-1-yl)ethanol?
2-(4-piperidin-4-ylpiperazin-1-yl)ethanol has a molecular weight of 213.32 g/mol, XLogP of -0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-piperidin-4-ylpiperazin-1-yl)ethanol is sourced from PubChem (CID 3831073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).