3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide

C13H13N3O4S — CID 105064331

IUPAC3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)Nc1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C13H13N3O4S/c1-20-12-8-15-6-5-11(12)13(17)16-9-3-2-4-10(7-9)21(14,18)19/h2-8H,1H3,(H,16,17)(H2,14,18,19)
InChIKeyAUOHRRQBOVGHOK-UHFFFAOYSA-N
MW307.33 g/mol
LogP0.99
Rot. Bonds4

About 3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide

3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide (PubChem CID 105064331) has the molecular formula C13H13N3O4S and a molecular weight of 307.33 g/mol. Its IUPAC name is 3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide
PubChem CID105064331
Molecular FormulaC13H13N3O4S
Molecular Weight307.33 g/mol
Exact Mass307.06
IUPAC Name3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)Nc1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C13H13N3O4S/c1-20-12-8-15-6-5-11(12)13(17)16-9-3-2-4-10(7-9)21(14,18)19/h2-8H,1H3,(H,16,17)(H2,14,18,19)
InChIKeyAUOHRRQBOVGHOK-UHFFFAOYSA-N
XLogP0.99
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide
CID 105063564
2-methoxy-N-(3-methoxyphenyl)-5-sulfamoylbenzamide
CID 27167646
N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide
CID 105062895
N-(4-amino-3-bromophenyl)-3-methoxypyridine-4-carboxamide
CID 105063037
3,5-dimethoxy-4-methyl-N-(3-sulfamoylphenyl)benzamide
CID 4241240
2-methyl-N-(3-sulfamoylphenyl)pyridine-3-carboxamide
CID 78950909
N-[3-(3-hydroxyprop-1-ynyl)phenyl]-3-methoxypyridine-4-carboxamide
CID 105064266
N-(3-fluoro-4-hydroxyphenyl)-3-methoxypyridine-4-carboxamide
CID 105063689
3-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)pyridine-4-carboxamide
CID 105064336
3-methoxy-N-(1H-pyrazol-4-yl)pyridine-4-carboxamide
CID 105063971
3-chloro-4,5-dimethoxy-N-(3-sulfamoylphenyl)benzamide
CID 9413012
5-amino-N-(3-sulfamoylphenyl)-1H-pyrazole-4-carboxamide
CID 43337194

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide?
The IUPAC name of 3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide (CID 105064331) is 3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide is COc1cnccc1C(=O)Nc1cccc(S(N)(=O)=O)c1.
What is the InChIKey of 3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide?
The InChIKey is AUOHRRQBOVGHOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O4S/c1-20-12-8-15-6-5-11(12)13(17)16-9-3-2-4-10(7-9)21(14,18)19/h2-8H,1H3,(H,16,17)(H2,14,18,19).
What are the key properties of 3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide?
3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide has a molecular weight of 307.33 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 105064331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).