[5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol

C12H8ClF2NO2 — CID 114920716

IUPAC[5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol
SMILESOCc1cc(Oc2cccc(F)c2F)ncc1Cl
InChIInChI=1S/C12H8ClF2NO2/c13-8-5-16-11(4-7(8)6-17)18-10-3-1-2-9(14)12(10)15/h1-5,17H,6H2
InChIKeyMMXFUALGQRPAHG-UHFFFAOYSA-N
MW271.65 g/mol
LogP3.30
Rot. Bonds3

About [5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol

[5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol (PubChem CID 114920716) has the molecular formula C12H8ClF2NO2 and a molecular weight of 271.65 g/mol. Its IUPAC name is [5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol
PubChem CID114920716
Molecular FormulaC12H8ClF2NO2
Molecular Weight271.65 g/mol
Exact Mass271.02
IUPAC Name[5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol
SMILESOCc1cc(Oc2cccc(F)c2F)ncc1Cl
InChIInChI=1S/C12H8ClF2NO2/c13-8-5-16-11(4-7(8)6-17)18-10-3-1-2-9(14)12(10)15/h1-5,17H,6H2
InChIKeyMMXFUALGQRPAHG-UHFFFAOYSA-N
XLogP3.30
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.65
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]-N-methylmethanamine
CID 114928630
[5-chloro-2-(2,6-dimethoxyphenoxy)-4-pyridinyl]methanol
CID 114920569
[6-(2,3-difluorophenoxy)-4-methyl-3-pyridinyl]methanamine
CID 157390984
N-[[5-chloro-2-(2-fluorophenoxy)-4-pyridinyl]methyl]propan-1-amine
CID 114928120
[2-(3-chloro-2-fluorophenoxy)-4-pyridinyl]methanol
CID 116689765
(5-chloro-2-quinolin-3-yloxy-4-pyridinyl)methanol
CID 107387669
[2-(5-bromo-2,3-difluorophenoxy)-5-chloro-4-pyridinyl]methanamine
CID 107101094
[5-chloro-2-(4-propylphenoxy)-4-pyridinyl]methanol
CID 114920713
[2-(2,3-difluorophenoxy)quinolin-3-yl]methanol
CID 63036604
N-[[5-chloro-2-(2-fluoro-5-methylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 114928781
8-[[5-chloro-4-(chloromethyl)-2-pyridinyl]oxy]quinoline
CID 114921266
[3-(3-chloro-2-fluorophenoxy)-4-pyridinyl]methanol
CID 105067223

Frequently Asked Questions

What is the IUPAC name of [5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol?
The IUPAC name of [5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol (CID 114920716) is [5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol.
What is the SMILES notation for [5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol?
The canonical SMILES for [5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol is OCc1cc(Oc2cccc(F)c2F)ncc1Cl.
What is the InChIKey of [5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol?
The InChIKey is MMXFUALGQRPAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClF2NO2/c13-8-5-16-11(4-7(8)6-17)18-10-3-1-2-9(14)12(10)15/h1-5,17H,6H2.
What are the key properties of [5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol?
[5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol has a molecular weight of 271.65 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-2-(2,3-difluorophenoxy)-4-pyridinyl]methanol is sourced from PubChem (CID 114920716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).