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

C12H9F2NO2 — CID 61256286

IUPAC[2-(2,4-difluorophenoxy)-3-pyridinyl]methanol
SMILESOCc1cccnc1Oc1ccc(F)cc1F
InChIInChI=1S/C12H9F2NO2/c13-9-3-4-11(10(14)6-9)17-12-8(7-16)2-1-5-15-12/h1-6,16H,7H2
InChIKeyXOCANRIDCJGRKP-UHFFFAOYSA-N
MW237.21 g/mol
LogP2.64
Rot. Bonds3

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

[2-(2,4-difluorophenoxy)-3-pyridinyl]methanol (PubChem CID 61256286) has the molecular formula C12H9F2NO2 and a molecular weight of 237.21 g/mol. Its IUPAC name is [2-(2,4-difluorophenoxy)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(2,4-difluorophenoxy)-3-pyridinyl]methanol
PubChem CID61256286
Molecular FormulaC12H9F2NO2
Molecular Weight237.21 g/mol
Exact Mass237.06
IUPAC Name[2-(2,4-difluorophenoxy)-3-pyridinyl]methanol
SMILESOCc1cccnc1Oc1ccc(F)cc1F
InChIInChI=1S/C12H9F2NO2/c13-9-3-4-11(10(14)6-9)17-12-8(7-16)2-1-5-15-12/h1-6,16H,7H2
InChIKeyXOCANRIDCJGRKP-UHFFFAOYSA-N
XLogP2.64
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.21
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-hydroxyacetamide
CID 56751588
2-(2,4-difluorophenoxy)-3-heptylpyridine
CID 59545722
[2-[2-(hydroxymethyl)phenoxy]-3-pyridinyl]methanol
CID 63653116
N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-hydroxypropanamide
CID 56738262
(2R)-2-amino-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]propanamide
CID 56759225
(2S)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-hydroxy-3-methylbutanamide
CID 95219679
[2-(2-ethylphenoxy)-3-pyridinyl]methanol
CID 61257757
N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-methyl-2-(methylamino)propanamide
CID 56759707
[2-(2-bromophenoxy)-3-pyridinyl]methanol
CID 61256696
N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 42196758
2-(4-chloro-2-fluorophenoxy)-3-(chloromethyl)pyridine
CID 114267909
(3R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-3-methylpentanamide
CID 95190027

Frequently Asked Questions

What is the IUPAC name of [2-(2,4-difluorophenoxy)-3-pyridinyl]methanol?
The IUPAC name of [2-(2,4-difluorophenoxy)-3-pyridinyl]methanol (CID 61256286) is [2-(2,4-difluorophenoxy)-3-pyridinyl]methanol.
What is the SMILES notation for [2-(2,4-difluorophenoxy)-3-pyridinyl]methanol?
The canonical SMILES for [2-(2,4-difluorophenoxy)-3-pyridinyl]methanol is OCc1cccnc1Oc1ccc(F)cc1F.
What is the InChIKey of [2-(2,4-difluorophenoxy)-3-pyridinyl]methanol?
The InChIKey is XOCANRIDCJGRKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2NO2/c13-9-3-4-11(10(14)6-9)17-12-8(7-16)2-1-5-15-12/h1-6,16H,7H2.
What are the key properties of [2-(2,4-difluorophenoxy)-3-pyridinyl]methanol?
[2-(2,4-difluorophenoxy)-3-pyridinyl]methanol has a molecular weight of 237.21 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,4-difluorophenoxy)-3-pyridinyl]methanol is sourced from PubChem (CID 61256286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).