5-(3,5-dichlorophenyl)-2,3-difluoropyridine

C11H5Cl2F2N — CID 133090630

IUPAC5-(3,5-dichlorophenyl)-2,3-difluoropyridine
SMILESFc1cc(-c2cc(Cl)cc(Cl)c2)cnc1F
InChIInChI=1S/C11H5Cl2F2N/c12-8-1-6(2-9(13)4-8)7-3-10(14)11(15)16-5-7/h1-5H
InChIKeyCHRKHHWUFWDCEF-UHFFFAOYSA-N
MW260.07 g/mol
LogP4.33
Rot. Bonds1

About 5-(3,5-dichlorophenyl)-2,3-difluoropyridine

5-(3,5-dichlorophenyl)-2,3-difluoropyridine (PubChem CID 133090630) has the molecular formula C11H5Cl2F2N and a molecular weight of 260.07 g/mol. Its IUPAC name is 5-(3,5-dichlorophenyl)-2,3-difluoropyridine.

Molecular Properties

Compound Name5-(3,5-dichlorophenyl)-2,3-difluoropyridine
PubChem CID133090630
Molecular FormulaC11H5Cl2F2N
Molecular Weight260.07 g/mol
Exact Mass258.98
IUPAC Name5-(3,5-dichlorophenyl)-2,3-difluoropyridine
SMILESFc1cc(-c2cc(Cl)cc(Cl)c2)cnc1F
InChIInChI=1S/C11H5Cl2F2N/c12-8-1-6(2-9(13)4-8)7-3-10(14)11(15)16-5-7/h1-5H
InChIKeyCHRKHHWUFWDCEF-UHFFFAOYSA-N
XLogP4.33
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.07
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 5-(3,5-dichlorophenyl)-2,3-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 5-(3,5-dichlorophenyl)-2,3-difluoropyridine?
The IUPAC name of 5-(3,5-dichlorophenyl)-2,3-difluoropyridine (CID 133090630) is 5-(3,5-dichlorophenyl)-2,3-difluoropyridine.
What is the SMILES notation for 5-(3,5-dichlorophenyl)-2,3-difluoropyridine?
The canonical SMILES for 5-(3,5-dichlorophenyl)-2,3-difluoropyridine is Fc1cc(-c2cc(Cl)cc(Cl)c2)cnc1F.
What is the InChIKey of 5-(3,5-dichlorophenyl)-2,3-difluoropyridine?
The InChIKey is CHRKHHWUFWDCEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl2F2N/c12-8-1-6(2-9(13)4-8)7-3-10(14)11(15)16-5-7/h1-5H.
What are the key properties of 5-(3,5-dichlorophenyl)-2,3-difluoropyridine?
5-(3,5-dichlorophenyl)-2,3-difluoropyridine has a molecular weight of 260.07 g/mol, XLogP of 4.33, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dichlorophenyl)-2,3-difluoropyridine is sourced from PubChem (CID 133090630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).