3-(2,4-dichlorophenyl)-2,5-difluoropyridine

C11H5Cl2F2N — CID 133090808

IUPAC3-(2,4-dichlorophenyl)-2,5-difluoropyridine
SMILESFc1cnc(F)c(-c2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C11H5Cl2F2N/c12-6-1-2-8(10(13)3-6)9-4-7(14)5-16-11(9)15/h1-5H
InChIKeyTWHKXUOUOHLJOQ-UHFFFAOYSA-N
MW260.07 g/mol
LogP4.33
Rot. Bonds1

About 3-(2,4-dichlorophenyl)-2,5-difluoropyridine

3-(2,4-dichlorophenyl)-2,5-difluoropyridine (PubChem CID 133090808) has the molecular formula C11H5Cl2F2N and a molecular weight of 260.07 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-2,5-difluoropyridine.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-2,5-difluoropyridine
PubChem CID133090808
Molecular FormulaC11H5Cl2F2N
Molecular Weight260.07 g/mol
Exact Mass258.98
IUPAC Name3-(2,4-dichlorophenyl)-2,5-difluoropyridine
SMILESFc1cnc(F)c(-c2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C11H5Cl2F2N/c12-6-1-2-8(10(13)3-6)9-4-7(14)5-16-11(9)15/h1-5H
InChIKeyTWHKXUOUOHLJOQ-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'}

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Related Compounds

5-(2,4-dichlorophenyl)-6-fluoropyridin-3-ol
CID 133093078
3-(2,3-dichlorophenyl)-2,5-difluoropyridine
CID 133090714
methyl 3-(2,4-dichlorophenyl)-5-fluoropyridine-2-carboxylate
CID 133090813
2-(2,4-dichlorophenyl)-5-fluoropyridine-3-carboxylic acid
CID 118824902
2-[5-(2,4-dichlorophenyl)-2-fluoro-3-pyridinyl]acetonitrile
CID 133094509
6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol
CID 119005357
2-(2,5-dichlorophenyl)-5-fluoropyridine
CID 118836279
3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde
CID 133090824
2-(2,4-dichlorophenyl)-4-fluoro-5-(trifluoromethyl)pyridine
CID 118847434
5-chloro-2-(2,4-dichlorophenyl)phenol
CID 174783468
2,4-dichloro-1-[3-fluoro-2-(trifluoromethyl)phenyl]benzene
CID 119002759
[2-(2,4-dichlorophenyl)-5-fluorophenyl]methanol
CID 118807413

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-2,5-difluoropyridine?
The IUPAC name of 3-(2,4-dichlorophenyl)-2,5-difluoropyridine (CID 133090808) is 3-(2,4-dichlorophenyl)-2,5-difluoropyridine.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-2,5-difluoropyridine?
The canonical SMILES for 3-(2,4-dichlorophenyl)-2,5-difluoropyridine is Fc1cnc(F)c(-c2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 3-(2,4-dichlorophenyl)-2,5-difluoropyridine?
The InChIKey is TWHKXUOUOHLJOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl2F2N/c12-6-1-2-8(10(13)3-6)9-4-7(14)5-16-11(9)15/h1-5H.
What are the key properties of 3-(2,4-dichlorophenyl)-2,5-difluoropyridine?
3-(2,4-dichlorophenyl)-2,5-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 3-(2,4-dichlorophenyl)-2,5-difluoropyridine is sourced from PubChem (CID 133090808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).