4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide

C19H16F2N2O2S — CID 11523645

IUPAC4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide
SMILESCc1cc(F)ccc1-c1ccc(NS(=O)(=O)c2ccc(F)cc2)nc1C
InChIInChI=1S/C19H16F2N2O2S/c1-12-11-15(21)5-8-17(12)18-9-10-19(22-13(18)2)23-26(24,25)16-6-3-14(20)4-7-16/h3-11H,1-2H3,(H,22,23)
InChIKeyRBCAOOPPNOVFHK-UHFFFAOYSA-N
MW374.41 g/mol
LogP4.44
Rot. Bonds4

About 4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide

4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide (PubChem CID 11523645) has the molecular formula C19H16F2N2O2S and a molecular weight of 374.41 g/mol. Its IUPAC name is 4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide.

Molecular Properties

Compound Name4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide
PubChem CID11523645
Molecular FormulaC19H16F2N2O2S
Molecular Weight374.41 g/mol
Exact Mass374.09
IUPAC Name4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide
SMILESCc1cc(F)ccc1-c1ccc(NS(=O)(=O)c2ccc(F)cc2)nc1C
InChIInChI=1S/C19H16F2N2O2S/c1-12-11-15(21)5-8-17(12)18-9-10-19(22-13(18)2)23-26(24,25)16-6-3-14(20)4-7-16/h3-11H,1-2H3,(H,22,23)
InChIKeyRBCAOOPPNOVFHK-UHFFFAOYSA-N
XLogP4.44
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.41
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

PF-915275
CID 23725123
4-tert-butyl-N-(6-methylpyridin-2-yl)benzenesulfonamide
CID 815224
N-(6-methylpyridin-2-yl)naphthalene-2-sulfonamide
CID 755284
N-(Pyridin-2-yl) arylsulfonamide, 12
CID 3812801
Biphenyl-4-sulfonic acid (6-methyl-pyridin-2-yl)-amide
CID 4982676
N-(Pyridin-2-yl) arylsulfonamide, 19
CID 44143308
N-(Pyridin-2-yl) arylsulfonamide, 20
CID 44143309
N-(Pyridin-2-yl) arylsulfonamide, 21
CID 44143310
N-(Pyridin-2-yl) arylsulfonamide, 22
CID 44143311
N-(Pyridin-2-yl) arylsulfonamide, 23
CID 44143312
N-(Pyridin-2-yl) arylsulfonamide, 24
CID 44143313
N-(Pyridin-2-yl) arylsulfonamide, 25
CID 44143314

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide?
The IUPAC name of 4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide (CID 11523645) is 4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide.
What is the SMILES notation for 4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide?
The canonical SMILES for 4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide is Cc1cc(F)ccc1-c1ccc(NS(=O)(=O)c2ccc(F)cc2)nc1C.
What is the InChIKey of 4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide?
The InChIKey is RBCAOOPPNOVFHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N2O2S/c1-12-11-15(21)5-8-17(12)18-9-10-19(22-13(18)2)23-26(24,25)16-6-3-14(20)4-7-16/h3-11H,1-2H3,(H,22,23).
What are the key properties of 4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide?
4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide has a molecular weight of 374.41 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[5-(4-fluoro-2-methylphenyl)-6-methyl-2-pyridinyl]benzenesulfonamide is sourced from PubChem (CID 11523645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).