N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide

C11H7Cl2FN2O2S — CID 103299127

IUPACN-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)c(Cl)c1)c1ncccc1F
InChIInChI=1S/C11H7Cl2FN2O2S/c12-8-4-3-7(6-9(8)13)16-19(17,18)11-10(14)2-1-5-15-11/h1-6,16H
InChIKeyLXWYCCUGVKRKTO-UHFFFAOYSA-N
MW321.16 g/mol
LogP3.33
Rot. Bonds3

About N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide

N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide (PubChem CID 103299127) has the molecular formula C11H7Cl2FN2O2S and a molecular weight of 321.16 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide
PubChem CID103299127
Molecular FormulaC11H7Cl2FN2O2S
Molecular Weight321.16 g/mol
Exact Mass319.96
IUPAC NameN-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)c(Cl)c1)c1ncccc1F
InChIInChI=1S/C11H7Cl2FN2O2S/c12-8-4-3-7(6-9(8)13)16-19(17,18)11-10(14)2-1-5-15-11/h1-6,16H
InChIKeyLXWYCCUGVKRKTO-UHFFFAOYSA-N
XLogP3.33
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.16
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide (CID 103299127) is N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide is O=S(=O)(Nc1ccc(Cl)c(Cl)c1)c1ncccc1F.
What is the InChIKey of N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide?
The InChIKey is LXWYCCUGVKRKTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl2FN2O2S/c12-8-4-3-7(6-9(8)13)16-19(17,18)11-10(14)2-1-5-15-11/h1-6,16H.
What are the key properties of N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide?
N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide has a molecular weight of 321.16 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 103299127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).