2-fluoro-5-(3,4,5-trichlorophenyl)pyridine

C11H5Cl3FN — CID 133089947

IUPAC2-fluoro-5-(3,4,5-trichlorophenyl)pyridine
SMILESFc1ccc(-c2cc(Cl)c(Cl)c(Cl)c2)cn1
InChIInChI=1S/C11H5Cl3FN/c12-8-3-7(4-9(13)11(8)14)6-1-2-10(15)16-5-6/h1-5H
InChIKeyIYIDEHWIFHGXGC-UHFFFAOYSA-N
MW276.53 g/mol
LogP4.85
Rot. Bonds1

About 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine

2-fluoro-5-(3,4,5-trichlorophenyl)pyridine (PubChem CID 133089947) has the molecular formula C11H5Cl3FN and a molecular weight of 276.53 g/mol. Its IUPAC name is 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine.

Molecular Properties

Compound Name2-fluoro-5-(3,4,5-trichlorophenyl)pyridine
PubChem CID133089947
Molecular FormulaC11H5Cl3FN
Molecular Weight276.53 g/mol
Exact Mass274.95
IUPAC Name2-fluoro-5-(3,4,5-trichlorophenyl)pyridine
SMILESFc1ccc(-c2cc(Cl)c(Cl)c(Cl)c2)cn1
InChIInChI=1S/C11H5Cl3FN/c12-8-3-7(4-9(13)11(8)14)6-1-2-10(15)16-5-6/h1-5H
InChIKeyIYIDEHWIFHGXGC-UHFFFAOYSA-N
XLogP4.85
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.53
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Analyze 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine with MolForge

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

Launch Full Analysis

Related Compounds

5-(3,4,5-trichlorophenyl)-2-(trifluoromethyl)pyridine
CID 134637957
3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine
CID 102169164
5-(2-chloro-5-fluoro-4-methylphenyl)-2-fluoropyridine
CID 170620232
5-(3,4,5-trichlorophenyl)pyrimidin-2-amine
CID 118996100
5-(3,4-dichlorophenyl)-2-fluoropyrimidine
CID 130167089
5-fluoro-2-(3,4,5-trichlorophenyl)pyridine
CID 133090365
[2-fluoro-5-(3,4,5-trichlorophenyl)-4-pyridinyl]methanol
CID 134636305
3,5-bis(3,4,5-trichlorophenyl)pyridine
CID 134623434
1,2,3-trichloro-5-(4-phenylphenyl)benzene
CID 71394428
2-chloro-5-(3,4,5-trifluorophenyl)pyridine
CID 57229619
2-fluoro-5-(4-methoxyphenyl)pyridine
CID 26985626
3-(6-fluoro-3-pyridinyl)-5-methylbenzaldehyde
CID 53485983

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine?
The IUPAC name of 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine (CID 133089947) is 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine.
What is the SMILES notation for 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine?
The canonical SMILES for 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine is Fc1ccc(-c2cc(Cl)c(Cl)c(Cl)c2)cn1.
What is the InChIKey of 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine?
The InChIKey is IYIDEHWIFHGXGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl3FN/c12-8-3-7(4-9(13)11(8)14)6-1-2-10(15)16-5-6/h1-5H.
What are the key properties of 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine?
2-fluoro-5-(3,4,5-trichlorophenyl)pyridine has a molecular weight of 276.53 g/mol, XLogP of 4.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-(3,4,5-trichlorophenyl)pyridine is sourced from PubChem (CID 133089947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).