5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine

C18H15FN2 — CID 57217721

IUPAC5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine
SMILESFc1ccc(-c2ccc(CCc3cccnc3)nc2)cc1
InChIInChI=1S/C18H15FN2/c19-17-7-4-15(5-8-17)16-6-10-18(21-13-16)9-3-14-2-1-11-20-12-14/h1-2,4-8,10-13H,3,9H2
InChIKeyPUGUWJRDSLFWHZ-UHFFFAOYSA-N
MW278.33 g/mol
LogP4.07
Rot. Bonds4

About 5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine

5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine (PubChem CID 57217721) has the molecular formula C18H15FN2 and a molecular weight of 278.33 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine
PubChem CID57217721
Molecular FormulaC18H15FN2
Molecular Weight278.33 g/mol
Exact Mass278.12
IUPAC Name5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine
SMILESFc1ccc(-c2ccc(CCc3cccnc3)nc2)cc1
InChIInChI=1S/C18H15FN2/c19-17-7-4-15(5-8-17)16-6-10-18(21-13-16)9-3-14-2-1-11-20-12-14/h1-2,4-8,10-13H,3,9H2
InChIKeyPUGUWJRDSLFWHZ-UHFFFAOYSA-N
XLogP4.07
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine?
The IUPAC name of 5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine (CID 57217721) is 5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine.
What is the SMILES notation for 5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine?
The canonical SMILES for 5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine is Fc1ccc(-c2ccc(CCc3cccnc3)nc2)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine?
The InChIKey is PUGUWJRDSLFWHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2/c19-17-7-4-15(5-8-17)16-6-10-18(21-13-16)9-3-14-2-1-11-20-12-14/h1-2,4-8,10-13H,3,9H2.
What are the key properties of 5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine?
5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine has a molecular weight of 278.33 g/mol, XLogP of 4.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-2-(2-pyridin-3-ylethyl)pyridine is sourced from PubChem (CID 57217721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).