5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine

C26H17FN2 — CID 169294016

IUPAC5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine
SMILESFc1ccc(-c2ccc3cc(-c4ccc(-c5cccnc5)nc4)ccc3c2)cc1
InChIInChI=1S/C26H17FN2/c27-25-10-7-18(8-11-25)19-3-4-21-15-22(6-5-20(21)14-19)23-9-12-26(29-17-23)24-2-1-13-28-16-24/h1-17H
InChIKeyHWAINZDFPUVAFY-UHFFFAOYSA-N
MW376.43 g/mol
LogP6.77
Rot. Bonds3

About 5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine

5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine (PubChem CID 169294016) has the molecular formula C26H17FN2 and a molecular weight of 376.43 g/mol. Its IUPAC name is 5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine.

Molecular Properties

Compound Name5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine
PubChem CID169294016
Molecular FormulaC26H17FN2
Molecular Weight376.43 g/mol
Exact Mass376.14
IUPAC Name5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine
SMILESFc1ccc(-c2ccc3cc(-c4ccc(-c5cccnc5)nc4)ccc3c2)cc1
InChIInChI=1S/C26H17FN2/c27-25-10-7-18(8-11-25)19-3-4-21-15-22(6-5-20(21)14-19)23-9-12-26(29-17-23)24-2-1-13-28-16-24/h1-17H
InChIKeyHWAINZDFPUVAFY-UHFFFAOYSA-N
XLogP6.77
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.43
LogP ≤ 56.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine?
The IUPAC name of 5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine (CID 169294016) is 5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine.
What is the SMILES notation for 5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine?
The canonical SMILES for 5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine is Fc1ccc(-c2ccc3cc(-c4ccc(-c5cccnc5)nc4)ccc3c2)cc1.
What is the InChIKey of 5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine?
The InChIKey is HWAINZDFPUVAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H17FN2/c27-25-10-7-18(8-11-25)19-3-4-21-15-22(6-5-20(21)14-19)23-9-12-26(29-17-23)24-2-1-13-28-16-24/h1-17H.
What are the key properties of 5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine?
5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine has a molecular weight of 376.43 g/mol, XLogP of 6.77, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine is sourced from PubChem (CID 169294016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).