2,3,4,5-tetrafluoro-6-methylpyridine

C6H3F4N — CID 15388342

IUPAC2,3,4,5-tetrafluoro-6-methylpyridine
SMILESCc1nc(F)c(F)c(F)c1F
InChIInChI=1S/C6H3F4N/c1-2-3(7)4(8)5(9)6(10)11-2/h1H3
InChIKeyURRWLJGJHFYVII-UHFFFAOYSA-N
MW165.09 g/mol
LogP1.95
Rot. Bonds

About 2,3,4,5-tetrafluoro-6-methylpyridine

2,3,4,5-tetrafluoro-6-methylpyridine (PubChem CID 15388342) has the molecular formula C6H3F4N and a molecular weight of 165.09 g/mol. Its IUPAC name is 2,3,4,5-tetrafluoro-6-methylpyridine.

Molecular Properties

Compound Name2,3,4,5-tetrafluoro-6-methylpyridine
PubChem CID15388342
Molecular FormulaC6H3F4N
Molecular Weight165.09 g/mol
Exact Mass165.02
IUPAC Name2,3,4,5-tetrafluoro-6-methylpyridine
SMILESCc1nc(F)c(F)c(F)c1F
InChIInChI=1S/C6H3F4N/c1-2-3(7)4(8)5(9)6(10)11-2/h1H3
InChIKeyURRWLJGJHFYVII-UHFFFAOYSA-N
XLogP1.95
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.09
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetrafluoro-6-methylpyridine?
The IUPAC name of 2,3,4,5-tetrafluoro-6-methylpyridine (CID 15388342) is 2,3,4,5-tetrafluoro-6-methylpyridine.
What is the SMILES notation for 2,3,4,5-tetrafluoro-6-methylpyridine?
The canonical SMILES for 2,3,4,5-tetrafluoro-6-methylpyridine is Cc1nc(F)c(F)c(F)c1F.
What is the InChIKey of 2,3,4,5-tetrafluoro-6-methylpyridine?
The InChIKey is URRWLJGJHFYVII-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F4N/c1-2-3(7)4(8)5(9)6(10)11-2/h1H3.
What are the key properties of 2,3,4,5-tetrafluoro-6-methylpyridine?
2,3,4,5-tetrafluoro-6-methylpyridine has a molecular weight of 165.09 g/mol, XLogP of 1.95, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetrafluoro-6-methylpyridine is sourced from PubChem (CID 15388342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).