5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine

C18H12F3NO2 — CID 141305084

IUPAC5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine
SMILESFc1ccc(COc2ccc(Oc3ccccc3F)nc2)cc1F
InChIInChI=1S/C18H12F3NO2/c19-14-7-5-12(9-16(14)21)11-23-13-6-8-18(22-10-13)24-17-4-2-1-3-15(17)20/h1-10H,11H2
InChIKeyRXWQJSLFIXBWAW-UHFFFAOYSA-N
MW331.29 g/mol
LogP4.87
Rot. Bonds5

About 5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine

5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine (PubChem CID 141305084) has the molecular formula C18H12F3NO2 and a molecular weight of 331.29 g/mol. Its IUPAC name is 5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine.

Molecular Properties

Compound Name5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine
PubChem CID141305084
Molecular FormulaC18H12F3NO2
Molecular Weight331.29 g/mol
Exact Mass331.08
IUPAC Name5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine
SMILESFc1ccc(COc2ccc(Oc3ccccc3F)nc2)cc1F
InChIInChI=1S/C18H12F3NO2/c19-14-7-5-12(9-16(14)21)11-23-13-6-8-18(22-10-13)24-17-4-2-1-3-15(17)20/h1-10H,11H2
InChIKeyRXWQJSLFIXBWAW-UHFFFAOYSA-N
XLogP4.87
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.29
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,2-difluoro-4-[(2-fluorophenoxy)methyl]benzene
CID 78846462
2-bromo-5-[(3,4-difluorophenyl)methoxy]pyridine
CID 103695236
[5-[(3,4-difluorophenyl)methoxy]-2-pyridinyl]methanol
CID 18758409
5-(bromomethyl)-2-(3,4-difluorophenoxy)pyridine
CID 107087768
2-(2-fluorophenoxy)-5-(trifluoromethyl)pyridine
CID 894987
4-[[2-(bromomethyl)phenoxy]methyl]-1,2-difluorobenzene
CID 82919067
6-(2-fluorophenoxy)pyridine-3-carbonitrile
CID 24698553
2-(2-chlorophenoxy)-5-[(2-chlorophenyl)methoxy]pyridine
CID 141305144
3-[(3,4-difluorophenyl)methoxy]pyridin-2-amine
CID 10331655
[7-[(3,4-difluorophenyl)methoxy]-1,5-naphthyridin-3-yl]methanol
CID 86301659
2-[(3,4-difluorophenyl)methoxy]pyrazine
CID 126954833
6-(2-fluorophenoxy)pyridine-3-carbonyl chloride
CID 23148937

Frequently Asked Questions

What is the IUPAC name of 5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine?
The IUPAC name of 5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine (CID 141305084) is 5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine.
What is the SMILES notation for 5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine?
The canonical SMILES for 5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine is Fc1ccc(COc2ccc(Oc3ccccc3F)nc2)cc1F.
What is the InChIKey of 5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine?
The InChIKey is RXWQJSLFIXBWAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F3NO2/c19-14-7-5-12(9-16(14)21)11-23-13-6-8-18(22-10-13)24-17-4-2-1-3-15(17)20/h1-10H,11H2.
What are the key properties of 5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine?
5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine has a molecular weight of 331.29 g/mol, XLogP of 4.87, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3,4-difluorophenyl)methoxy]-2-(2-fluorophenoxy)pyridine is sourced from PubChem (CID 141305084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).