3-fluoro-2-(3-fluorophenyl)-6-methylpyridine

C12H9F2N — CID 46312581

IUPAC3-fluoro-2-(3-fluorophenyl)-6-methylpyridine
SMILESCc1ccc(F)c(-c2cccc(F)c2)n1
InChIInChI=1S/C12H9F2N/c1-8-5-6-11(14)12(15-8)9-3-2-4-10(13)7-9/h2-7H,1H3
InChIKeyLVMKKUXXRLJRSS-UHFFFAOYSA-N
MW205.21 g/mol
LogP3.34
Rot. Bonds1

About 3-fluoro-2-(3-fluorophenyl)-6-methylpyridine

3-fluoro-2-(3-fluorophenyl)-6-methylpyridine (PubChem CID 46312581) has the molecular formula C12H9F2N and a molecular weight of 205.21 g/mol. Its IUPAC name is 3-fluoro-2-(3-fluorophenyl)-6-methylpyridine.

Molecular Properties

Compound Name3-fluoro-2-(3-fluorophenyl)-6-methylpyridine
PubChem CID46312581
Molecular FormulaC12H9F2N
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name3-fluoro-2-(3-fluorophenyl)-6-methylpyridine
SMILESCc1ccc(F)c(-c2cccc(F)c2)n1
InChIInChI=1S/C12H9F2N/c1-8-5-6-11(14)12(15-8)9-3-2-4-10(13)7-9/h2-7H,1H3
InChIKeyLVMKKUXXRLJRSS-UHFFFAOYSA-N
XLogP3.34
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-(3-fluorophenyl)-6-methylpyridine?
The IUPAC name of 3-fluoro-2-(3-fluorophenyl)-6-methylpyridine (CID 46312581) is 3-fluoro-2-(3-fluorophenyl)-6-methylpyridine.
What is the SMILES notation for 3-fluoro-2-(3-fluorophenyl)-6-methylpyridine?
The canonical SMILES for 3-fluoro-2-(3-fluorophenyl)-6-methylpyridine is Cc1ccc(F)c(-c2cccc(F)c2)n1.
What is the InChIKey of 3-fluoro-2-(3-fluorophenyl)-6-methylpyridine?
The InChIKey is LVMKKUXXRLJRSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2N/c1-8-5-6-11(14)12(15-8)9-3-2-4-10(13)7-9/h2-7H,1H3.
What are the key properties of 3-fluoro-2-(3-fluorophenyl)-6-methylpyridine?
3-fluoro-2-(3-fluorophenyl)-6-methylpyridine has a molecular weight of 205.21 g/mol, XLogP of 3.34, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(3-fluorophenyl)-6-methylpyridine is sourced from PubChem (CID 46312581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).