2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride

C12H19ClN2O — CID 71637869

IUPAC2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride
SMILESCC(O[C@@H]1CCCNC1)c1ccccn1.Cl
InChIInChI=1S/C12H18N2O.ClH/c1-10(12-6-2-3-8-14-12)15-11-5-4-7-13-9-11;/h2-3,6,8,10-11,13H,4-5,7,9H2,1H3;1H/t10?,11-;/m1./s1
InChIKeyFRFPQYBOSJINIO-PSDUUTOMSA-N
MW242.75 g/mol
LogP2.33
Rot. Bonds3

About 2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride

2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride (PubChem CID 71637869) has the molecular formula C12H19ClN2O and a molecular weight of 242.75 g/mol. Its IUPAC name is 2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride.

Molecular Properties

Compound Name2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride
PubChem CID71637869
Molecular FormulaC12H19ClN2O
Molecular Weight242.75 g/mol
Exact Mass242.12
IUPAC Name2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride
SMILESCC(O[C@@H]1CCCNC1)c1ccccn1.Cl
InChIInChI=1S/C12H18N2O.ClH/c1-10(12-6-2-3-8-14-12)15-11-5-4-7-13-9-11;/h2-3,6,8,10-11,13H,4-5,7,9H2,1H3;1H/t10?,11-;/m1./s1
InChIKeyFRFPQYBOSJINIO-PSDUUTOMSA-N
XLogP2.33
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.75
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-piperidin-4-yloxyethyl)pyridine
CID 71637942
(3R)-3-[(1S)-1-phenylethoxy]piperidine
CID 129369907
(3R)-N-(1-pyridin-2-ylethyl)piperidin-3-amine;hydrochloride
CID 71637625
(3R)-N-methyl-N-(1-pyridin-2-ylethyl)piperidin-3-amine
CID 71637504
(3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine
CID 71637655
(3R)-3-[(1S)-1-(1H-pyrrol-2-yl)ethoxy]piperidine
CID 97162337
(3S)-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
CID 81407106
3-propan-2-yloxypiperidine;hydrochloride
CID 53409755
(3R)-N-methyl-N-(1-pyridin-2-ylethyl)pyrrolidin-3-amine;hydrochloride
CID 71637515
3-piperidin-3-yloxy-6-pyridin-2-ylpyridazine
CID 130229783
N-(piperidin-3-ylmethyl)-1-pyridin-2-ylethanesulfonamide;hydrochloride
CID 71637453
2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine
CID 97162432

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride?
The IUPAC name of 2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride (CID 71637869) is 2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride.
What is the SMILES notation for 2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride?
The canonical SMILES for 2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride is CC(O[C@@H]1CCCNC1)c1ccccn1.Cl.
What is the InChIKey of 2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride?
The InChIKey is FRFPQYBOSJINIO-PSDUUTOMSA-N. The full InChI is InChI=1S/C12H18N2O.ClH/c1-10(12-6-2-3-8-14-12)15-11-5-4-7-13-9-11;/h2-3,6,8,10-11,13H,4-5,7,9H2,1H3;1H/t10?,11-;/m1./s1.
What are the key properties of 2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride?
2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride has a molecular weight of 242.75 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(3R)-piperidin-3-yl]oxyethyl]pyridine;hydrochloride is sourced from PubChem (CID 71637869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).