3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride

C12H19ClN2O — CID 56830402

IUPAC3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride
SMILESCl.c1cncc(OCCC2CCCCN2)c1
InChIInChI=1S/C12H18N2O.ClH/c1-2-8-14-11(4-1)6-9-15-12-5-3-7-13-10-12;/h3,5,7,10-11,14H,1-2,4,6,8-9H2;1H
InChIKeyIKOSQZNPSFEXSC-UHFFFAOYSA-N
MW242.75 g/mol
LogP2.41
Rot. Bonds4

About 3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride

3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride (PubChem CID 56830402) has the molecular formula C12H19ClN2O and a molecular weight of 242.75 g/mol. Its IUPAC name is 3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride.

Molecular Properties

Compound Name3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride
PubChem CID56830402
Molecular FormulaC12H19ClN2O
Molecular Weight242.75 g/mol
Exact Mass242.12
IUPAC Name3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride
SMILESCl.c1cncc(OCCC2CCCCN2)c1
InChIInChI=1S/C12H18N2O.ClH/c1-2-8-14-11(4-1)6-9-15-12-5-3-7-13-10-12;/h3,5,7,10-11,14H,1-2,4,6,8-9H2;1H
InChIKeyIKOSQZNPSFEXSC-UHFFFAOYSA-N
XLogP2.41
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.75
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;dihydrochloride
CID 138393569
3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
CID 10535320
5-[2-[(2R)-pyrrolidin-2-yl]ethoxy]pyrimidine
CID 97057121
2-[(2R)-piperidin-2-yl]ethyl pyridine-3-carboxylate
CID 86319798
3-(2-piperidin-2-ylethoxy)pyridazine
CID 62483689
(2S)-2-[2-(4-phenylphenoxy)ethyl]piperidine
CID 28749943
2-[2-(4-benzylphenoxy)ethyl]piperidine;hydrochloride
CID 56830376
3-(2-piperidin-3-ylethoxy)pyridine;hydrochloride
CID 56830400
(2S)-2-[2-(3-phenylphenoxy)ethyl]piperidine
CID 59752871
(2R)-2-[2-(4-ethoxyphenoxy)ethyl]piperidine
CID 28749865
3-[[(2R)-azetidin-2-yl]methoxy]pyridine;dihydrochloride
CID 18391704
(2S)-2-[2-(3-ethylphenoxy)ethyl]piperidine
CID 28749803

Frequently Asked Questions

What is the IUPAC name of 3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride?
The IUPAC name of 3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride (CID 56830402) is 3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride.
What is the SMILES notation for 3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride?
The canonical SMILES for 3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride is Cl.c1cncc(OCCC2CCCCN2)c1.
What is the InChIKey of 3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride?
The InChIKey is IKOSQZNPSFEXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O.ClH/c1-2-8-14-11(4-1)6-9-15-12-5-3-7-13-10-12;/h3,5,7,10-11,14H,1-2,4,6,8-9H2;1H.
What are the key properties of 3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride?
3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride has a molecular weight of 242.75 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride is sourced from PubChem (CID 56830402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).