2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide

C11H7ClF2N2O2S — CID 61076644

IUPAC2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide
SMILESO=S(=O)(Nc1cccc(F)c1F)c1ccnc(Cl)c1
InChIInChI=1S/C11H7ClF2N2O2S/c12-10-6-7(4-5-15-10)19(17,18)16-9-3-1-2-8(13)11(9)14/h1-6,16H
InChIKeyBGHVIUSRHKOZKO-UHFFFAOYSA-N
MW304.71 g/mol
LogP2.81
Rot. Bonds3

About 2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide

2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide (PubChem CID 61076644) has the molecular formula C11H7ClF2N2O2S and a molecular weight of 304.71 g/mol. Its IUPAC name is 2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide
PubChem CID61076644
Molecular FormulaC11H7ClF2N2O2S
Molecular Weight304.71 g/mol
Exact Mass303.99
IUPAC Name2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide
SMILESO=S(=O)(Nc1cccc(F)c1F)c1ccnc(Cl)c1
InChIInChI=1S/C11H7ClF2N2O2S/c12-10-6-7(4-5-15-10)19(17,18)16-9-3-1-2-8(13)11(9)14/h1-6,16H
InChIKeyBGHVIUSRHKOZKO-UHFFFAOYSA-N
XLogP2.81
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.71
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide?
The IUPAC name of 2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide (CID 61076644) is 2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide?
The canonical SMILES for 2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide is O=S(=O)(Nc1cccc(F)c1F)c1ccnc(Cl)c1.
What is the InChIKey of 2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide?
The InChIKey is BGHVIUSRHKOZKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClF2N2O2S/c12-10-6-7(4-5-15-10)19(17,18)16-9-3-1-2-8(13)11(9)14/h1-6,16H.
What are the key properties of 2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide?
2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide has a molecular weight of 304.71 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide is sourced from PubChem (CID 61076644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).