2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide

C20H19N3O5S — CID 28578712

IUPAC2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
SMILESCOc1cccc(OC)c1C(=O)Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1
InChIInChI=1S/C20H19N3O5S/c1-27-17-6-3-7-18(28-2)19(17)20(24)22-14-8-10-16(11-9-14)29(25,26)23-15-5-4-12-21-13-15/h3-13,23H,1-2H3,(H,22,24)
InChIKeyGOCCXBJJFGHJDU-UHFFFAOYSA-N
MW413.46 g/mol
LogP3.15
Rot. Bonds7

About 2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide

2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide (PubChem CID 28578712) has the molecular formula C20H19N3O5S and a molecular weight of 413.46 g/mol. Its IUPAC name is 2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
PubChem CID28578712
Molecular FormulaC20H19N3O5S
Molecular Weight413.46 g/mol
Exact Mass413.10
IUPAC Name2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
SMILESCOc1cccc(OC)c1C(=O)Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1
InChIInChI=1S/C20H19N3O5S/c1-27-17-6-3-7-18(28-2)19(17)20(24)22-14-8-10-16(11-9-14)29(25,26)23-15-5-4-12-21-13-15/h3-13,23H,1-2H3,(H,22,24)
InChIKeyGOCCXBJJFGHJDU-UHFFFAOYSA-N
XLogP3.15
TPSA106.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.46
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 92646313
7-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide
CID 46763363
N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
CID 4263456
3-iodo-4-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzenesulfonamide
CID 99940779
2-methoxy-5-morpholin-4-ylsulfonyl-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 43876086
2,6-dimethoxy-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]benzamide
CID 1181025
(2S)-2-(4-methoxyphenoxy)-N-[4-(pyridin-3-ylsulfamoyl)phenyl]propanamide
CID 28632657
2,6-dimethoxy-N-(4-sulfamoylphenyl)benzamide
CID 954656
5-[(4-acetamidophenyl)sulfonylamino]-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 46345779
4-acetyl-N-pyridin-3-ylbenzenesulfonamide
CID 22750329
3-amino-4-methoxy-N-pyridin-3-ylbenzenesulfonamide
CID 29275645
5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 43904807

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide (CID 28578712) is 2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide is COc1cccc(OC)c1C(=O)Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1.
What is the InChIKey of 2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The InChIKey is GOCCXBJJFGHJDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O5S/c1-27-17-6-3-7-18(28-2)19(17)20(24)22-14-8-10-16(11-9-14)29(25,26)23-15-5-4-12-21-13-15/h3-13,23H,1-2H3,(H,22,24).
What are the key properties of 2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide has a molecular weight of 413.46 g/mol, XLogP of 3.15, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 28578712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).