N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide

C17H11ClF2N2O2S — CID 11531026

IUPACN-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccc(-c2ccccc2Cl)cn1)c1cc(F)ccc1F
InChIInChI=1S/C17H11ClF2N2O2S/c18-14-4-2-1-3-13(14)11-5-8-17(21-10-11)22-25(23,24)16-9-12(19)6-7-15(16)20/h1-10H,(H,21,22)
InChIKeyADGFMGKCIZYIFN-UHFFFAOYSA-N
MW380.80 g/mol
LogP4.48
Rot. Bonds4

About N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide

N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide (PubChem CID 11531026) has the molecular formula C17H11ClF2N2O2S and a molecular weight of 380.80 g/mol. Its IUPAC name is N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide.

Molecular Properties

Compound NameN-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide
PubChem CID11531026
Molecular FormulaC17H11ClF2N2O2S
Molecular Weight380.80 g/mol
Exact Mass380.02
IUPAC NameN-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccc(-c2ccccc2Cl)cn1)c1cc(F)ccc1F
InChIInChI=1S/C17H11ClF2N2O2S/c18-14-4-2-1-3-13(14)11-5-8-17(21-10-11)22-25(23,24)16-9-12(19)6-7-15(16)20/h1-10H,(H,21,22)
InChIKeyADGFMGKCIZYIFN-UHFFFAOYSA-N
XLogP4.48
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.80
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide?
The IUPAC name of N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide (CID 11531026) is N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide.
What is the SMILES notation for N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide?
The canonical SMILES for N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide is O=S(=O)(Nc1ccc(-c2ccccc2Cl)cn1)c1cc(F)ccc1F.
What is the InChIKey of N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide?
The InChIKey is ADGFMGKCIZYIFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClF2N2O2S/c18-14-4-2-1-3-13(14)11-5-8-17(21-10-11)22-25(23,24)16-9-12(19)6-7-15(16)20/h1-10H,(H,21,22).
What are the key properties of N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide?
N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide has a molecular weight of 380.80 g/mol, XLogP of 4.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide is sourced from PubChem (CID 11531026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).