5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine

C11H5Cl3FN — CID 133090435

IUPAC5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine
SMILESFc1cc(Cl)cnc1-c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C11H5Cl3FN/c12-7-1-6(2-8(13)3-7)11-10(15)4-9(14)5-16-11/h1-5H
InChIKeyIFOHHXNTHLPIJD-UHFFFAOYSA-N
MW276.53 g/mol
LogP4.85
Rot. Bonds1

About 5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine

5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine (PubChem CID 133090435) has the molecular formula C11H5Cl3FN and a molecular weight of 276.53 g/mol. Its IUPAC name is 5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine.

Molecular Properties

Compound Name5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine
PubChem CID133090435
Molecular FormulaC11H5Cl3FN
Molecular Weight276.53 g/mol
Exact Mass274.95
IUPAC Name5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine
SMILESFc1cc(Cl)cnc1-c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C11H5Cl3FN/c12-7-1-6(2-8(13)3-7)11-10(15)4-9(14)5-16-11/h1-5H
InChIKeyIFOHHXNTHLPIJD-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

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine?
The IUPAC name of 5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine (CID 133090435) is 5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine.
What is the SMILES notation for 5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine?
The canonical SMILES for 5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine is Fc1cc(Cl)cnc1-c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine?
The InChIKey is IFOHHXNTHLPIJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl3FN/c12-7-1-6(2-8(13)3-7)11-10(15)4-9(14)5-16-11/h1-5H.
What are the key properties of 5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine?
5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine 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 5-chloro-2-(3,5-dichlorophenyl)-3-fluoropyridine is sourced from PubChem (CID 133090435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).