2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine

C18H15FN2O — CID 163196433

IUPAC2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine
SMILESFc1ccc(CCOc2ccc(-c3cccnc3)cn2)cc1
InChIInChI=1S/C18H15FN2O/c19-17-6-3-14(4-7-17)9-11-22-18-8-5-16(13-21-18)15-2-1-10-20-12-15/h1-8,10,12-13H,9,11H2
InChIKeyORFSLMVMPYSSHX-UHFFFAOYSA-N
MW294.33 g/mol
LogP3.90
Rot. Bonds5

About 2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine

2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine (PubChem CID 163196433) has the molecular formula C18H15FN2O and a molecular weight of 294.33 g/mol. Its IUPAC name is 2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine.

Molecular Properties

Compound Name2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine
PubChem CID163196433
Molecular FormulaC18H15FN2O
Molecular Weight294.33 g/mol
Exact Mass294.12
IUPAC Name2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine
SMILESFc1ccc(CCOc2ccc(-c3cccnc3)cn2)cc1
InChIInChI=1S/C18H15FN2O/c19-17-6-3-14(4-7-17)9-11-22-18-8-5-16(13-21-18)15-2-1-10-20-12-15/h1-8,10,12-13H,9,11H2
InChIKeyORFSLMVMPYSSHX-UHFFFAOYSA-N
XLogP3.90
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine?
The IUPAC name of 2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine (CID 163196433) is 2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine.
What is the SMILES notation for 2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine?
The canonical SMILES for 2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine is Fc1ccc(CCOc2ccc(-c3cccnc3)cn2)cc1.
What is the InChIKey of 2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine?
The InChIKey is ORFSLMVMPYSSHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O/c19-17-6-3-14(4-7-17)9-11-22-18-8-5-16(13-21-18)15-2-1-10-20-12-15/h1-8,10,12-13H,9,11H2.
What are the key properties of 2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine?
2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine has a molecular weight of 294.33 g/mol, XLogP of 3.90, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorophenyl)ethoxy]-5-pyridin-3-ylpyridine is sourced from PubChem (CID 163196433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).