2-ethoxy-3,6-bis(4-fluorophenyl)pyridine

C19H15F2NO — CID 138757069

IUPAC2-ethoxy-3,6-bis(4-fluorophenyl)pyridine
SMILESCCOc1nc(-c2ccc(F)cc2)ccc1-c1ccc(F)cc1
InChIInChI=1S/C19H15F2NO/c1-2-23-19-17(13-3-7-15(20)8-4-13)11-12-18(22-19)14-5-9-16(21)10-6-14/h3-12H,2H2,1H3
InChIKeyLZZLTEUBEOFVIR-UHFFFAOYSA-N
MW311.33 g/mol
LogP5.09
Rot. Bonds4

About 2-ethoxy-3,6-bis(4-fluorophenyl)pyridine

2-ethoxy-3,6-bis(4-fluorophenyl)pyridine (PubChem CID 138757069) has the molecular formula C19H15F2NO and a molecular weight of 311.33 g/mol. Its IUPAC name is 2-ethoxy-3,6-bis(4-fluorophenyl)pyridine.

Molecular Properties

Compound Name2-ethoxy-3,6-bis(4-fluorophenyl)pyridine
PubChem CID138757069
Molecular FormulaC19H15F2NO
Molecular Weight311.33 g/mol
Exact Mass311.11
IUPAC Name2-ethoxy-3,6-bis(4-fluorophenyl)pyridine
SMILESCCOc1nc(-c2ccc(F)cc2)ccc1-c1ccc(F)cc1
InChIInChI=1S/C19H15F2NO/c1-2-23-19-17(13-3-7-15(20)8-4-13)11-12-18(22-19)14-5-9-16(21)10-6-14/h3-12H,2H2,1H3
InChIKeyLZZLTEUBEOFVIR-UHFFFAOYSA-N
XLogP5.09
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.33
LogP ≤ 55.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Quinisocaine
CID 6857
Dimethisoquin Hydrochloride
CID 9883104
2-Methoxy-4,6-diphenylpyridine-3-carbonitrile
CID 678565
2-Methyl-6-(3-p-tolyloxy-prop-1-ynyl)pyridine
CID 11481793
2-(4-Fluoro-2,6-dimethylphenoxy)-3,6-dimethyl-4-(pentan-3-yloxy)pyridine
CID 21912361
2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol
CID 134158356
6-Fluoro-3,4-dihydro-2H-pyrano[2,3-b]quinolin-5-amine
CID 612726
4-(4-Fluorophenyl)-2-methoxy-6-phenylpyridine-3-carbonitrile
CID 789665
2-(4-Methoxyphenyl)-4,6-diphenylpyridine
CID 1719430
2-(4-Fluorophenoxy)-4,6-dimethylpyridine-3-carbonitrile
CID 723818
Ethyl 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]acetate
CID 2813721
2-ethoxy-4-(4-fluorophenyl)-5H-indeno[1,2-b]pyridine-3-carbonitrile
CID 2816367

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3,6-bis(4-fluorophenyl)pyridine?
The IUPAC name of 2-ethoxy-3,6-bis(4-fluorophenyl)pyridine (CID 138757069) is 2-ethoxy-3,6-bis(4-fluorophenyl)pyridine.
What is the SMILES notation for 2-ethoxy-3,6-bis(4-fluorophenyl)pyridine?
The canonical SMILES for 2-ethoxy-3,6-bis(4-fluorophenyl)pyridine is CCOc1nc(-c2ccc(F)cc2)ccc1-c1ccc(F)cc1.
What is the InChIKey of 2-ethoxy-3,6-bis(4-fluorophenyl)pyridine?
The InChIKey is LZZLTEUBEOFVIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2NO/c1-2-23-19-17(13-3-7-15(20)8-4-13)11-12-18(22-19)14-5-9-16(21)10-6-14/h3-12H,2H2,1H3.
What are the key properties of 2-ethoxy-3,6-bis(4-fluorophenyl)pyridine?
2-ethoxy-3,6-bis(4-fluorophenyl)pyridine has a molecular weight of 311.33 g/mol, XLogP of 5.09, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3,6-bis(4-fluorophenyl)pyridine is sourced from PubChem (CID 138757069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).