2,4,6-tribromo-3,5-difluoropyridine

C5Br3F2N — CID 2778700

IUPAC2,4,6-tribromo-3,5-difluoropyridine
SMILESFc1c(Br)nc(Br)c(F)c1Br
InChIInChI=1S/C5Br3F2N/c6-1-2(9)4(7)11-5(8)3(1)10
InChIKeyGKWOSYZICRXPCI-UHFFFAOYSA-N
MW351.77 g/mol
LogP3.65
Rot. Bonds

About 2,4,6-tribromo-3,5-difluoropyridine

2,4,6-tribromo-3,5-difluoropyridine (PubChem CID 2778700) has the molecular formula C5Br3F2N and a molecular weight of 351.77 g/mol. Its IUPAC name is 2,4,6-tribromo-3,5-difluoropyridine.

Molecular Properties

Compound Name2,4,6-tribromo-3,5-difluoropyridine
PubChem CID2778700
Molecular FormulaC5Br3F2N
Molecular Weight351.77 g/mol
Exact Mass348.75
IUPAC Name2,4,6-tribromo-3,5-difluoropyridine
SMILESFc1c(Br)nc(Br)c(F)c1Br
InChIInChI=1S/C5Br3F2N/c6-1-2(9)4(7)11-5(8)3(1)10
InChIKeyGKWOSYZICRXPCI-UHFFFAOYSA-N
XLogP3.65
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.77
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2,4,6-tribromo-3,5-difluoropyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,4,6-tribromo-3,5-difluoropyridine?
The IUPAC name of 2,4,6-tribromo-3,5-difluoropyridine (CID 2778700) is 2,4,6-tribromo-3,5-difluoropyridine.
What is the SMILES notation for 2,4,6-tribromo-3,5-difluoropyridine?
The canonical SMILES for 2,4,6-tribromo-3,5-difluoropyridine is Fc1c(Br)nc(Br)c(F)c1Br.
What is the InChIKey of 2,4,6-tribromo-3,5-difluoropyridine?
The InChIKey is GKWOSYZICRXPCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5Br3F2N/c6-1-2(9)4(7)11-5(8)3(1)10.
What are the key properties of 2,4,6-tribromo-3,5-difluoropyridine?
2,4,6-tribromo-3,5-difluoropyridine has a molecular weight of 351.77 g/mol, XLogP of 3.65, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-tribromo-3,5-difluoropyridine is sourced from PubChem (CID 2778700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).