2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol

C12H17ClN2O — CID 63586332

IUPAC2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol
SMILESOCCC1CCCCN1c1cccc(Cl)n1
InChIInChI=1S/C12H17ClN2O/c13-11-5-3-6-12(14-11)15-8-2-1-4-10(15)7-9-16/h3,5-6,10,16H,1-2,4,7-9H2
InChIKeyBELGOLHESFPCLK-UHFFFAOYSA-N
MW240.73 g/mol
LogP2.48
Rot. Bonds3

About 2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol

2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol (PubChem CID 63586332) has the molecular formula C12H17ClN2O and a molecular weight of 240.73 g/mol. Its IUPAC name is 2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol
PubChem CID63586332
Molecular FormulaC12H17ClN2O
Molecular Weight240.73 g/mol
Exact Mass240.10
IUPAC Name2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol
SMILESOCCC1CCCCN1c1cccc(Cl)n1
InChIInChI=1S/C12H17ClN2O/c13-11-5-3-6-12(14-11)15-8-2-1-4-10(15)7-9-16/h3,5-6,10,16H,1-2,4,7-9H2
InChIKeyBELGOLHESFPCLK-UHFFFAOYSA-N
XLogP2.48
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.73
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-[1-(4-amino-6-chloro-2-pyridinyl)piperidin-2-yl]ethanol
CID 114070518
2-[1-(6-hydrazinyl-2-pyridinyl)piperidin-2-yl]ethanol
CID 80928543
2-[1-(6-chloro-2-cyclopropylpyrimidin-4-yl)piperidin-2-yl]ethanol
CID 80948989
[1-(6-chloro-2-pyridinyl)pyrrolidin-2-yl]methanamine;hydrochloride
CID 23369489
2-[1-(5,6-dimethylpyrazin-2-yl)piperidin-2-yl]ethanol
CID 114476751
2-chloro-6-[2-(2-hydroxyethyl)piperidin-1-yl]benzenecarbothioamide
CID 55079597
2-bromo-6-(2-propylpiperidin-1-yl)pyridine
CID 83056141
2-chloro-N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]benzenecarboximidamide
CID 76945268
1-(6-chloro-2-pyridinyl)-N-methylpiperidine-2-carboxamide
CID 63585985
6-chloro-2-[2-(2-hydroxyethyl)piperidin-1-yl]quinoline-4-carbonitrile
CID 133426490
2-[1-(3,4-dichlorophenyl)pyrrolidin-2-yl]ethanol
CID 117028575
[6-(2-methylpiperidin-1-yl)-2-pyridinyl]methanol
CID 62253556

Frequently Asked Questions

What is the IUPAC name of 2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol (CID 63586332) is 2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol is OCCC1CCCCN1c1cccc(Cl)n1.
What is the InChIKey of 2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol?
The InChIKey is BELGOLHESFPCLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O/c13-11-5-3-6-12(14-11)15-8-2-1-4-10(15)7-9-16/h3,5-6,10,16H,1-2,4,7-9H2.
What are the key properties of 2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol?
2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol has a molecular weight of 240.73 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(6-chloro-2-pyridinyl)piperidin-2-yl]ethanol is sourced from PubChem (CID 63586332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).