2-[(6-chloro-3-pyridinyl)oxy]ethanol

C7H8ClNO2 — CID 22036297

IUPAC2-[(6-chloro-3-pyridinyl)oxy]ethanol
SMILESOCCOc1ccc(Cl)nc1
InChIInChI=1S/C7H8ClNO2/c8-7-2-1-6(5-9-7)11-4-3-10/h1-2,5,10H,3-4H2
InChIKeyUHVWCVZADAZAIQ-UHFFFAOYSA-N
MW173.60 g/mol
LogP1.11
Rot. Bonds3

About 2-[(6-chloro-3-pyridinyl)oxy]ethanol

2-[(6-chloro-3-pyridinyl)oxy]ethanol (PubChem CID 22036297) has the molecular formula C7H8ClNO2 and a molecular weight of 173.60 g/mol. Its IUPAC name is 2-[(6-chloro-3-pyridinyl)oxy]ethanol.

Molecular Properties

Compound Name2-[(6-chloro-3-pyridinyl)oxy]ethanol
PubChem CID22036297
Molecular FormulaC7H8ClNO2
Molecular Weight173.60 g/mol
Exact Mass173.02
IUPAC Name2-[(6-chloro-3-pyridinyl)oxy]ethanol
SMILESOCCOc1ccc(Cl)nc1
InChIInChI=1S/C7H8ClNO2/c8-7-2-1-6(5-9-7)11-4-3-10/h1-2,5,10H,3-4H2
InChIKeyUHVWCVZADAZAIQ-UHFFFAOYSA-N
XLogP1.11
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.60
LogP ≤ 51.11
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

6-[(6-chloro-3-pyridinyl)oxy]hexan-1-ol
CID 103867951
2-[(6-bromo-3-pyridinyl)oxy]ethanol
CID 86643980
2-chloro-5-(4,4,4-trifluorobutoxy)pyridine
CID 115519759
CID 162335780
CID 162335780
(6-chloro-3-pyridinyl)oxymethyl-trimethylsilane
CID 130680161
5-(2-tert-butylsulfonylethoxy)-2-chloropyridine
CID 106735269
methyl 2-[(6-chloro-3-pyridinyl)oxy]acetate
CID 86099194
2-(2-methylpyrimidin-5-yl)oxyethanol
CID 117230630
2-[(6-chloro-5-fluoro-3-pyridinyl)oxy]ethanol
CID 155272542
2-chloro-5-(oxiran-2-ylmethoxy)pyridine
CID 87132450
2-[3-chloro-5-(2-hydroxyethoxy)phenoxy]ethanol
CID 54038432
2-chloro-5-(4-ethoxyphenyl)pyridine
CID 19765548

Frequently Asked Questions

What is the IUPAC name of 2-[(6-chloro-3-pyridinyl)oxy]ethanol?
The IUPAC name of 2-[(6-chloro-3-pyridinyl)oxy]ethanol (CID 22036297) is 2-[(6-chloro-3-pyridinyl)oxy]ethanol.
What is the SMILES notation for 2-[(6-chloro-3-pyridinyl)oxy]ethanol?
The canonical SMILES for 2-[(6-chloro-3-pyridinyl)oxy]ethanol is OCCOc1ccc(Cl)nc1.
What is the InChIKey of 2-[(6-chloro-3-pyridinyl)oxy]ethanol?
The InChIKey is UHVWCVZADAZAIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNO2/c8-7-2-1-6(5-9-7)11-4-3-10/h1-2,5,10H,3-4H2.
What are the key properties of 2-[(6-chloro-3-pyridinyl)oxy]ethanol?
2-[(6-chloro-3-pyridinyl)oxy]ethanol has a molecular weight of 173.60 g/mol, XLogP of 1.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-chloro-3-pyridinyl)oxy]ethanol is sourced from PubChem (CID 22036297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).