1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol

C11H23NO3 — CID 103684371

IUPAC1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol
SMILESCC(O)C1CCN(CCOCCO)CC1
InChIInChI=1S/C11H23NO3/c1-10(14)11-2-4-12(5-3-11)6-8-15-9-7-13/h10-11,13-14H,2-9H2,1H3
InChIKeyIXRUNKDLXFJIHM-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.09
Rot. Bonds6

About 1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol

1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol (PubChem CID 103684371) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol.

Molecular Properties

Compound Name1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol
PubChem CID103684371
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol
SMILESCC(O)C1CCN(CCOCCO)CC1
InChIInChI=1S/C11H23NO3/c1-10(14)11-2-4-12(5-3-11)6-8-15-9-7-13/h10-11,13-14H,2-9H2,1H3
InChIKeyIXRUNKDLXFJIHM-UHFFFAOYSA-N
XLogP0.09
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol?
The IUPAC name of 1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol (CID 103684371) is 1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol.
What is the SMILES notation for 1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol?
The canonical SMILES for 1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol is CC(O)C1CCN(CCOCCO)CC1.
What is the InChIKey of 1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol?
The InChIKey is IXRUNKDLXFJIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-10(14)11-2-4-12(5-3-11)6-8-15-9-7-13/h10-11,13-14H,2-9H2,1H3.
What are the key properties of 1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol?
1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol has a molecular weight of 217.31 g/mol, XLogP of 0.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol is sourced from PubChem (CID 103684371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).