2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide

C11H8Cl2N2O2S — CID 669153

IUPAC2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide
SMILESO=S(=O)(Nc1ccccn1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C11H8Cl2N2O2S/c12-8-4-5-9(13)10(7-8)18(16,17)15-11-3-1-2-6-14-11/h1-7H,(H,14,15)
InChIKeyBZDFKUYNBYPTQR-UHFFFAOYSA-N
MW303.17 g/mol
LogP3.19
Rot. Bonds3

About 2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide

2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide (PubChem CID 669153) has the molecular formula C11H8Cl2N2O2S and a molecular weight of 303.17 g/mol. Its IUPAC name is 2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide
PubChem CID669153
Molecular FormulaC11H8Cl2N2O2S
Molecular Weight303.17 g/mol
Exact Mass301.97
IUPAC Name2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide
SMILESO=S(=O)(Nc1ccccn1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C11H8Cl2N2O2S/c12-8-4-5-9(13)10(7-8)18(16,17)15-11-3-1-2-6-14-11/h1-7H,(H,14,15)
InChIKeyBZDFKUYNBYPTQR-UHFFFAOYSA-N
XLogP3.19
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.17
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide?
The IUPAC name of 2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide (CID 669153) is 2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide.
What is the SMILES notation for 2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide?
The canonical SMILES for 2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide is O=S(=O)(Nc1ccccn1)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide?
The InChIKey is BZDFKUYNBYPTQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2O2S/c12-8-4-5-9(13)10(7-8)18(16,17)15-11-3-1-2-6-14-11/h1-7H,(H,14,15).
What are the key properties of 2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide?
2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide has a molecular weight of 303.17 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-pyridin-2-ylbenzenesulfonamide is sourced from PubChem (CID 669153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).