2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide

C12H10F2N2O2S — CID 19683145

IUPAC2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide
SMILESCc1cccc(NS(=O)(=O)c2ccc(F)cc2F)n1
InChIInChI=1S/C12H10F2N2O2S/c1-8-3-2-4-12(15-8)16-19(17,18)11-6-5-9(13)7-10(11)14/h2-7H,1H3,(H,15,16)
InChIKeyHNSOIFRIIIKXQB-UHFFFAOYSA-N
MW284.29 g/mol
LogP2.47
Rot. Bonds3

About 2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide

2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide (PubChem CID 19683145) has the molecular formula C12H10F2N2O2S and a molecular weight of 284.29 g/mol. Its IUPAC name is 2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide
PubChem CID19683145
Molecular FormulaC12H10F2N2O2S
Molecular Weight284.29 g/mol
Exact Mass284.04
IUPAC Name2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide
SMILESCc1cccc(NS(=O)(=O)c2ccc(F)cc2F)n1
InChIInChI=1S/C12H10F2N2O2S/c1-8-3-2-4-12(15-8)16-19(17,18)11-6-5-9(13)7-10(11)14/h2-7H,1H3,(H,15,16)
InChIKeyHNSOIFRIIIKXQB-UHFFFAOYSA-N
XLogP2.47
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.29
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide (CID 19683145) is 2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide is Cc1cccc(NS(=O)(=O)c2ccc(F)cc2F)n1.
What is the InChIKey of 2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
The InChIKey is HNSOIFRIIIKXQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2N2O2S/c1-8-3-2-4-12(15-8)16-19(17,18)11-6-5-9(13)7-10(11)14/h2-7H,1H3,(H,15,16).
What are the key properties of 2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide has a molecular weight of 284.29 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-(6-methyl-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 19683145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).