3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide

C19H13F2N3O6S2 — CID 57399860

IUPAC3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide
SMILESO=C(NS(=O)(=O)c1ccc(F)cc1)c1cncc(C(=O)NS(=O)(=O)c2ccc(F)cc2)c1
InChIInChI=1S/C19H13F2N3O6S2/c20-14-1-5-16(6-2-14)31(27,28)23-18(25)12-9-13(11-22-10-12)19(26)24-32(29,30)17-7-3-15(21)4-8-17/h1-11H,(H,23,25)(H,24,26)
InChIKeyFSNGJQINSSIKCT-UHFFFAOYSA-N
MW481.46 g/mol
LogP1.60
Rot. Bonds6

About 3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide

3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide (PubChem CID 57399860) has the molecular formula C19H13F2N3O6S2 and a molecular weight of 481.46 g/mol. Its IUPAC name is 3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide
PubChem CID57399860
Molecular FormulaC19H13F2N3O6S2
Molecular Weight481.46 g/mol
Exact Mass481.02
IUPAC Name3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide
SMILESO=C(NS(=O)(=O)c1ccc(F)cc1)c1cncc(C(=O)NS(=O)(=O)c2ccc(F)cc2)c1
InChIInChI=1S/C19H13F2N3O6S2/c20-14-1-5-16(6-2-14)31(27,28)23-18(25)12-9-13(11-22-10-12)19(26)24-32(29,30)17-7-3-15(21)4-8-17/h1-11H,(H,23,25)(H,24,26)
InChIKeyFSNGJQINSSIKCT-UHFFFAOYSA-N
XLogP1.60
TPSA139.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.46
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

5-(benzenesulfonamido)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 20910390
N-(4-fluorophenyl)sulfonyl-3-(methylsulfonylmethyl)benzamide
CID 110166612
N-(4-fluorophenyl)sulfonyl-4-(4-methylpiperazin-1-yl)benzamide
CID 155988728
2-(4-fluorophenyl)-N-(4-fluorophenyl)sulfonylacetamide
CID 56683687
N-(4-fluorophenyl)sulfonyl-2-methylpropanamide
CID 47268952
3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(4-fluorophenyl)sulfonylbenzamide
CID 110166622
1-[(2S)-butan-2-yl]-N-(4-fluorophenyl)sulfonyl-5-methylpyrazole-4-carboxamide
CID 99859445
4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide
CID 175173681
5-[4-[(3,4-difluorophenyl)methylamino]phenoxy]-N-(3,4-difluorophenyl)sulfonylpyridine-3-carboxamide
CID 66881770
1-cyclohexyl-N-(4-fluorophenyl)sulfonyl-2-methylbenzimidazole-5-carboxamide
CID 110166636
N-[4-(2-aminoethyl)phenyl]sulfonylpyridine-3-carboxamide
CID 110839438
3-(1,1-dioxothiazinan-2-yl)-N-(4-fluorophenyl)sulfonylbenzamide
CID 110166635

Frequently Asked Questions

What is the IUPAC name of 3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide?
The IUPAC name of 3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide (CID 57399860) is 3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide.
What is the SMILES notation for 3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide?
The canonical SMILES for 3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide is O=C(NS(=O)(=O)c1ccc(F)cc1)c1cncc(C(=O)NS(=O)(=O)c2ccc(F)cc2)c1.
What is the InChIKey of 3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide?
The InChIKey is FSNGJQINSSIKCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F2N3O6S2/c20-14-1-5-16(6-2-14)31(27,28)23-18(25)12-9-13(11-22-10-12)19(26)24-32(29,30)17-7-3-15(21)4-8-17/h1-11H,(H,23,25)(H,24,26).
What are the key properties of 3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide?
3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide has a molecular weight of 481.46 g/mol, XLogP of 1.60, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide is sourced from PubChem (CID 57399860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).