5-(2,6-difluorophenyl)-2-ethylpyridine

C13H11F2N — CID 171801039

IUPAC5-(2,6-difluorophenyl)-2-ethylpyridine
SMILESCCc1ccc(-c2c(F)cccc2F)cn1
InChIInChI=1S/C13H11F2N/c1-2-10-7-6-9(8-16-10)13-11(14)4-3-5-12(13)15/h3-8H,2H2,1H3
InChIKeyDOZPFWGUKFPFFR-UHFFFAOYSA-N
MW219.23 g/mol
LogP3.59
Rot. Bonds2

About 5-(2,6-difluorophenyl)-2-ethylpyridine

5-(2,6-difluorophenyl)-2-ethylpyridine (PubChem CID 171801039) has the molecular formula C13H11F2N and a molecular weight of 219.23 g/mol. Its IUPAC name is 5-(2,6-difluorophenyl)-2-ethylpyridine.

Molecular Properties

Compound Name5-(2,6-difluorophenyl)-2-ethylpyridine
PubChem CID171801039
Molecular FormulaC13H11F2N
Molecular Weight219.23 g/mol
Exact Mass219.09
IUPAC Name5-(2,6-difluorophenyl)-2-ethylpyridine
SMILESCCc1ccc(-c2c(F)cccc2F)cn1
InChIInChI=1S/C13H11F2N/c1-2-10-7-6-9(8-16-10)13-11(14)4-3-5-12(13)15/h3-8H,2H2,1H3
InChIKeyDOZPFWGUKFPFFR-UHFFFAOYSA-N
XLogP3.59
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.23
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(2,6-difluorophenyl)-2-ethylpyridine?
The IUPAC name of 5-(2,6-difluorophenyl)-2-ethylpyridine (CID 171801039) is 5-(2,6-difluorophenyl)-2-ethylpyridine.
What is the SMILES notation for 5-(2,6-difluorophenyl)-2-ethylpyridine?
The canonical SMILES for 5-(2,6-difluorophenyl)-2-ethylpyridine is CCc1ccc(-c2c(F)cccc2F)cn1.
What is the InChIKey of 5-(2,6-difluorophenyl)-2-ethylpyridine?
The InChIKey is DOZPFWGUKFPFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2N/c1-2-10-7-6-9(8-16-10)13-11(14)4-3-5-12(13)15/h3-8H,2H2,1H3.
What are the key properties of 5-(2,6-difluorophenyl)-2-ethylpyridine?
5-(2,6-difluorophenyl)-2-ethylpyridine has a molecular weight of 219.23 g/mol, XLogP of 3.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-difluorophenyl)-2-ethylpyridine is sourced from PubChem (CID 171801039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).