3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine

C12H10F2N2 — CID 135282385

IUPAC3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine
SMILESCc1cc(-c2ccc(F)c(CF)n2)ccn1
InChIInChI=1S/C12H10F2N2/c1-8-6-9(4-5-15-8)11-3-2-10(14)12(7-13)16-11/h2-6H,7H2,1H3
InChIKeyBZDBROSUDZRXIB-UHFFFAOYSA-N
MW220.22 g/mol
LogP3.06
Rot. Bonds2

About 3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine

3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine (PubChem CID 135282385) has the molecular formula C12H10F2N2 and a molecular weight of 220.22 g/mol. Its IUPAC name is 3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine.

Molecular Properties

Compound Name3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine
PubChem CID135282385
Molecular FormulaC12H10F2N2
Molecular Weight220.22 g/mol
Exact Mass220.08
IUPAC Name3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine
SMILESCc1cc(-c2ccc(F)c(CF)n2)ccn1
InChIInChI=1S/C12H10F2N2/c1-8-6-9(4-5-15-8)11-3-2-10(14)12(7-13)16-11/h2-6H,7H2,1H3
InChIKeyBZDBROSUDZRXIB-UHFFFAOYSA-N
XLogP3.06
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.22
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine?
The IUPAC name of 3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine (CID 135282385) is 3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine.
What is the SMILES notation for 3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine?
The canonical SMILES for 3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine is Cc1cc(-c2ccc(F)c(CF)n2)ccn1.
What is the InChIKey of 3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine?
The InChIKey is BZDBROSUDZRXIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2N2/c1-8-6-9(4-5-15-8)11-3-2-10(14)12(7-13)16-11/h2-6H,7H2,1H3.
What are the key properties of 3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine?
3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine has a molecular weight of 220.22 g/mol, XLogP of 3.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(fluoromethyl)-6-(2-methyl-4-pyridinyl)pyridine is sourced from PubChem (CID 135282385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).