N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide

C13H14N2O4S — CID 25048223

IUPACN-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2cccnc2)cc1OC
InChIInChI=1S/C13H14N2O4S/c1-18-12-6-5-10(8-13(12)19-2)15-20(16,17)11-4-3-7-14-9-11/h3-9,15H,1-2H3
InChIKeyAELZXIMJDJPXIP-UHFFFAOYSA-N
MW294.33 g/mol
LogP1.90
Rot. Bonds5

About N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide

N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide (PubChem CID 25048223) has the molecular formula C13H14N2O4S and a molecular weight of 294.33 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide
PubChem CID25048223
Molecular FormulaC13H14N2O4S
Molecular Weight294.33 g/mol
Exact Mass294.07
IUPAC NameN-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2cccnc2)cc1OC
InChIInChI=1S/C13H14N2O4S/c1-18-12-6-5-10(8-13(12)19-2)15-20(16,17)11-4-3-7-14-9-11/h3-9,15H,1-2H3
InChIKeyAELZXIMJDJPXIP-UHFFFAOYSA-N
XLogP1.90
TPSA77.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chloro-4-methoxyphenyl)pyridine-3-sulfonamide
CID 110865835
3-iodo-4-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzenesulfonamide
CID 99940779
3-amino-4-methoxy-N-pyridin-3-ylbenzenesulfonamide
CID 29275645
N-(4-methyl-3-sulfamoylphenyl)pyridine-3-sulfonamide
CID 61131422
N-(3-iodophenyl)pyridine-3-sulfonamide
CID 61400317
N-(4-propan-2-ylphenyl)pyridine-3-sulfonamide
CID 110865791
N-[3-(pyridin-3-ylsulfonylamino)phenyl]acetamide
CID 110865862
N-[3-chloro-4-[(5-chloro-3-pyridinyl)oxy]phenyl]pyridine-3-sulfonamide
CID 23515243
N-(3-chloro-5,6-dimethoxy-2-pyridinyl)pyridine-3-sulfonamide
CID 140673297
N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]pyridine-3-sulfonamide
CID 166184500
5-(benzenesulfonamido)-N-(3,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 20910382
3,4-dimethoxy-N-[3-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenyl]benzenesulfonamide
CID 108784254

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide (CID 25048223) is N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide is COc1ccc(NS(=O)(=O)c2cccnc2)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide?
The InChIKey is AELZXIMJDJPXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O4S/c1-18-12-6-5-10(8-13(12)19-2)15-20(16,17)11-4-3-7-14-9-11/h3-9,15H,1-2H3.
What are the key properties of N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide?
N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide has a molecular weight of 294.33 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 25048223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).