3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride

C11H24ClNO2 — CID 56829882

IUPAC3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride
SMILESCCOCCOCCC1CCCNC1.Cl
InChIInChI=1S/C11H23NO2.ClH/c1-2-13-8-9-14-7-5-11-4-3-6-12-10-11;/h11-12H,2-10H2,1H3;1H
InChIKeyDCGASSNEWZJMLW-UHFFFAOYSA-N
MW237.77 g/mol
LogP1.85
Rot. Bonds7

About 3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride

3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride (PubChem CID 56829882) has the molecular formula C11H24ClNO2 and a molecular weight of 237.77 g/mol. Its IUPAC name is 3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride.

Molecular Properties

Compound Name3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride
PubChem CID56829882
Molecular FormulaC11H24ClNO2
Molecular Weight237.77 g/mol
Exact Mass237.15
IUPAC Name3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride
SMILESCCOCCOCCC1CCCNC1.Cl
InChIInChI=1S/C11H23NO2.ClH/c1-2-13-8-9-14-7-5-11-4-3-6-12-10-11;/h11-12H,2-10H2,1H3;1H
InChIKeyDCGASSNEWZJMLW-UHFFFAOYSA-N
XLogP1.85
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.77
LogP ≤ 51.85
H-Bond Donors ≤ 51
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-(2-propoxyethoxy)ethyl]piperidine;hydrochloride
CID 56830022
3-[2-(2-butoxyethoxy)ethyl]piperidine
CID 62357528
3-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]azepane
CID 104680798
2-(2-piperidin-3-ylethoxy)ethanol
CID 104680589
3-(ethoxymethyl)piperidine;hydrochloride
CID 17178071
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-(cyclobutylmethoxy)ethyl]piperidine
CID 56830620
(3R)-3-(ethoxymethyl)piperidine
CID 42427178
(3S)-3-(ethoxymethyl)piperidine
CID 42427180

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride?
The IUPAC name of 3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride (CID 56829882) is 3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride.
What is the SMILES notation for 3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride?
The canonical SMILES for 3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride is CCOCCOCCC1CCCNC1.Cl.
What is the InChIKey of 3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride?
The InChIKey is DCGASSNEWZJMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2.ClH/c1-2-13-8-9-14-7-5-11-4-3-6-12-10-11;/h11-12H,2-10H2,1H3;1H.
What are the key properties of 3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride?
3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride has a molecular weight of 237.77 g/mol, XLogP of 1.85, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride is sourced from PubChem (CID 56829882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).