N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide

C19H15F2N3O4S — CID 20910450

IUPACN-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide
SMILESCOc1ccc(S(=O)(=O)Nc2cncc(C(=O)Nc3ccc(F)c(F)c3)c2)cc1
InChIInChI=1S/C19H15F2N3O4S/c1-28-15-3-5-16(6-4-15)29(26,27)24-14-8-12(10-22-11-14)19(25)23-13-2-7-17(20)18(21)9-13/h2-11,24H,1H3,(H,23,25)
InChIKeyLNMBNWAJXIUQLB-UHFFFAOYSA-N
MW419.41 g/mol
LogP3.42
Rot. Bonds6

About N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide

N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide (PubChem CID 20910450) has the molecular formula C19H15F2N3O4S and a molecular weight of 419.41 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide
PubChem CID20910450
Molecular FormulaC19H15F2N3O4S
Molecular Weight419.41 g/mol
Exact Mass419.08
IUPAC NameN-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide
SMILESCOc1ccc(S(=O)(=O)Nc2cncc(C(=O)Nc3ccc(F)c(F)c3)c2)cc1
InChIInChI=1S/C19H15F2N3O4S/c1-28-15-3-5-16(6-4-15)29(26,27)24-14-8-12(10-22-11-14)19(25)23-13-2-7-17(20)18(21)9-13/h2-11,24H,1H3,(H,23,25)
InChIKeyLNMBNWAJXIUQLB-UHFFFAOYSA-N
XLogP3.42
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.41
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(4-methoxyphenyl)sulfonylamino]-N-phenylpyridine-3-carboxamide
CID 20910442
5-[(4-acetamidophenyl)sulfonylamino]-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 46345779
5-(benzenesulfonamido)-N-(3,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 20910382
5-(benzenesulfonamido)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 20910390
4-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)benzamide
CID 17391179
N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26579550
3-N-(3,4-difluorophenyl)-5-N-propan-2-ylpyridine-3,5-dicarboxamide
CID 109101520
N-(4-methoxyphenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide
CID 109223486
3,4-difluoro-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]benzamide
CID 30451320
N-(3,4-dimethoxyphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26695232
N-(3,4-dimethylphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26593901
N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7553556

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide?
The IUPAC name of N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide (CID 20910450) is N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide is COc1ccc(S(=O)(=O)Nc2cncc(C(=O)Nc3ccc(F)c(F)c3)c2)cc1.
What is the InChIKey of N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide?
The InChIKey is LNMBNWAJXIUQLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N3O4S/c1-28-15-3-5-16(6-4-15)29(26,27)24-14-8-12(10-22-11-14)19(25)23-13-2-7-17(20)18(21)9-13/h2-11,24H,1H3,(H,23,25).
What are the key properties of N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide?
N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide has a molecular weight of 419.41 g/mol, XLogP of 3.42, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-5-[(4-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide is sourced from PubChem (CID 20910450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).