2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine

C17H12F2N2 — CID 158927077

IUPAC2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine
SMILESFc1ccc(-c2cccc(Cc3ccccn3)n2)c(F)c1
InChIInChI=1S/C17H12F2N2/c18-12-7-8-15(16(19)10-12)17-6-3-5-14(21-17)11-13-4-1-2-9-20-13/h1-10H,11H2
InChIKeyKUFBSFJMSBVMFS-UHFFFAOYSA-N
MW282.29 g/mol
LogP4.01
Rot. Bonds3

About 2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine

2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine (PubChem CID 158927077) has the molecular formula C17H12F2N2 and a molecular weight of 282.29 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine
PubChem CID158927077
Molecular FormulaC17H12F2N2
Molecular Weight282.29 g/mol
Exact Mass282.10
IUPAC Name2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine
SMILESFc1ccc(-c2cccc(Cc3ccccn3)n2)c(F)c1
InChIInChI=1S/C17H12F2N2/c18-12-7-8-15(16(19)10-12)17-6-3-5-14(21-17)11-13-4-1-2-9-20-13/h1-10H,11H2
InChIKeyKUFBSFJMSBVMFS-UHFFFAOYSA-N
XLogP4.01
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.29
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine?
The IUPAC name of 2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine (CID 158927077) is 2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine.
What is the SMILES notation for 2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine?
The canonical SMILES for 2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine is Fc1ccc(-c2cccc(Cc3ccccn3)n2)c(F)c1.
What is the InChIKey of 2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine?
The InChIKey is KUFBSFJMSBVMFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12F2N2/c18-12-7-8-15(16(19)10-12)17-6-3-5-14(21-17)11-13-4-1-2-9-20-13/h1-10H,11H2.
What are the key properties of 2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine?
2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine has a molecular weight of 282.29 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-6-(pyridin-2-ylmethyl)pyridine is sourced from PubChem (CID 158927077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).