3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol

C9H19NO3 — CID 114451802

IUPAC3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol
SMILESOCCOCCC1CNCCC1O
InChIInChI=1S/C9H19NO3/c11-4-6-13-5-2-8-7-10-3-1-9(8)12/h8-12H,1-7H2
InChIKeyCJZHQVGFXVBXNJ-UHFFFAOYSA-N
MW189.25 g/mol
LogP-0.64
Rot. Bonds5

About 3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol

3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol (PubChem CID 114451802) has the molecular formula C9H19NO3 and a molecular weight of 189.25 g/mol. Its IUPAC name is 3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol.

Molecular Properties

Compound Name3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol
PubChem CID114451802
Molecular FormulaC9H19NO3
Molecular Weight189.25 g/mol
Exact Mass189.14
IUPAC Name3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol
SMILESOCCOCCC1CNCCC1O
InChIInChI=1S/C9H19NO3/c11-4-6-13-5-2-8-7-10-3-1-9(8)12/h8-12H,1-7H2
InChIKeyCJZHQVGFXVBXNJ-UHFFFAOYSA-N
XLogP-0.64
TPSA61.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 5-0.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol
CID 114451772
2-(2-piperidin-3-ylethoxy)ethanol
CID 104680589
(3S,4S)-3-(cyclopropylmethyl)piperidin-4-ol
CID 129393768
3-[2-(4-methoxyphenoxy)ethyl]piperidin-4-ol
CID 114451831
3-(2-hydroxy-3-methoxypropyl)piperidin-4-ol
CID 114451767
2-[2-(4-methylpiperidin-3-yl)oxyethoxy]ethanol
CID 106939216
3-[2-(oxolan-3-yl)ethyl]piperidin-4-ol
CID 130803009
3-(3-hydroxy-2-methylpropyl)piperidin-4-ol
CID 114451948
(3S,4S)-3-(2-methylpropyl)piperidin-4-ol
CID 93495959
(3R,4R)-3-(2-methylpropyl)piperidin-4-ol
CID 93495960
3-[[4-(hydroxymethyl)phenyl]methyl]piperidin-4-ol
CID 114451747
3-(2-methoxypropyl)piperidin-4-ol
CID 114451812

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol?
The IUPAC name of 3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol (CID 114451802) is 3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol.
What is the SMILES notation for 3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol?
The canonical SMILES for 3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol is OCCOCCC1CNCCC1O.
What is the InChIKey of 3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol?
The InChIKey is CJZHQVGFXVBXNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3/c11-4-6-13-5-2-8-7-10-3-1-9(8)12/h8-12H,1-7H2.
What are the key properties of 3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol?
3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol has a molecular weight of 189.25 g/mol, XLogP of -0.64, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol is sourced from PubChem (CID 114451802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).