2-(2-piperidin-3-ylethoxy)ethanol

C9H19NO2 — CID 104680589

IUPAC2-(2-piperidin-3-ylethoxy)ethanol
SMILESOCCOCCC1CCCNC1
InChIInChI=1S/C9H19NO2/c11-5-7-12-6-3-9-2-1-4-10-8-9/h9-11H,1-8H2
InChIKeyFPPHBFUSLSWZGF-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.38
Rot. Bonds5

About 2-(2-piperidin-3-ylethoxy)ethanol

2-(2-piperidin-3-ylethoxy)ethanol (PubChem CID 104680589) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-(2-piperidin-3-ylethoxy)ethanol.

Molecular Properties

Compound Name2-(2-piperidin-3-ylethoxy)ethanol
PubChem CID104680589
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-(2-piperidin-3-ylethoxy)ethanol
SMILESOCCOCCC1CCCNC1
InChIInChI=1S/C9H19NO2/c11-5-7-12-6-3-9-2-1-4-10-8-9/h9-11H,1-8H2
InChIKeyFPPHBFUSLSWZGF-UHFFFAOYSA-N
XLogP0.38
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(cyclobutylmethoxy)ethyl]piperidine
CID 56830620
3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride
CID 56829882
3-[2-(2-butoxyethoxy)ethyl]piperidine
CID 62357528
3-[2-(2-propoxyethoxy)ethyl]piperidine;hydrochloride
CID 56830022
3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine
CID 55064528
3-[2-(3-methylbutoxy)ethyl]piperidine
CID 53409519
(3R)-3-[2-(3-methylbutoxy)ethyl]piperidine
CID 86320703
3-[2-(methoxymethoxy)ethyl]piperidine
CID 106938134
3-[2-(2-chloroprop-2-enoxy)ethyl]piperidine
CID 62356668
3-[2-(2-pyrrolidin-1-ylethoxy)ethyl]piperidine
CID 62356152
(3S)-3-[2-(2-methylprop-2-enoxy)ethyl]piperidine
CID 86320862
2,2-dimethyl-3-(2-piperidin-3-ylethoxy)propanoic acid
CID 106939866

Frequently Asked Questions

What is the IUPAC name of 2-(2-piperidin-3-ylethoxy)ethanol?
The IUPAC name of 2-(2-piperidin-3-ylethoxy)ethanol (CID 104680589) is 2-(2-piperidin-3-ylethoxy)ethanol.
What is the SMILES notation for 2-(2-piperidin-3-ylethoxy)ethanol?
The canonical SMILES for 2-(2-piperidin-3-ylethoxy)ethanol is OCCOCCC1CCCNC1.
What is the InChIKey of 2-(2-piperidin-3-ylethoxy)ethanol?
The InChIKey is FPPHBFUSLSWZGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c11-5-7-12-6-3-9-2-1-4-10-8-9/h9-11H,1-8H2.
What are the key properties of 2-(2-piperidin-3-ylethoxy)ethanol?
2-(2-piperidin-3-ylethoxy)ethanol has a molecular weight of 173.26 g/mol, XLogP of 0.38, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-piperidin-3-ylethoxy)ethanol is sourced from PubChem (CID 104680589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).