2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide

C12H14N4O4S — CID 61129046

IUPAC2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1nn(C)cc1S(N)(=O)=O
InChIInChI=1S/C12H14N4O4S/c1-16-7-10(21(13,18)19)11(15-16)14-12(17)8-5-3-4-6-9(8)20-2/h3-7H,1-2H3,(H2,13,18,19)(H,14,15,17)
InChIKeyIDXQMBQDLYESRE-UHFFFAOYSA-N
MW310.33 g/mol
LogP0.33
Rot. Bonds4

About 2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide

2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide (PubChem CID 61129046) has the molecular formula C12H14N4O4S and a molecular weight of 310.33 g/mol. Its IUPAC name is 2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide.

Molecular Properties

Compound Name2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
PubChem CID61129046
Molecular FormulaC12H14N4O4S
Molecular Weight310.33 g/mol
Exact Mass310.07
IUPAC Name2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1nn(C)cc1S(N)(=O)=O
InChIInChI=1S/C12H14N4O4S/c1-16-7-10(21(13,18)19)11(15-16)14-12(17)8-5-3-4-6-9(8)20-2/h3-7H,1-2H3,(H2,13,18,19)(H,14,15,17)
InChIKeyIDXQMBQDLYESRE-UHFFFAOYSA-N
XLogP0.33
TPSA116.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.33
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)pyridine-4-carboxamide
CID 105064336
2,4-difluoro-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
CID 61129231
2,4-dimethyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
CID 61129233
3-bromo-2-fluoro-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
CID 107953731
2-bromo-5-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
CID 81111625
2-chloro-N-(1-methyl-4-sulfamoylpyrazol-3-yl)furan-3-carboxamide
CID 106689384
5-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)-1,2-oxazole-4-carboxamide
CID 61131374
N-(1-methyl-4-sulfamoylpyrazol-3-yl)furan-3-carboxamide
CID 61131275
1-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)pyrazole-4-carboxamide
CID 61132038
1,5-dimethyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)pyrazole-3-carboxamide
CID 114219136
2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide
CID 61131141
2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)pyridine-4-carboxamide
CID 106753989

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide?
The IUPAC name of 2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide (CID 61129046) is 2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide.
What is the SMILES notation for 2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide?
The canonical SMILES for 2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide is COc1ccccc1C(=O)Nc1nn(C)cc1S(N)(=O)=O.
What is the InChIKey of 2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide?
The InChIKey is IDXQMBQDLYESRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O4S/c1-16-7-10(21(13,18)19)11(15-16)14-12(17)8-5-3-4-6-9(8)20-2/h3-7H,1-2H3,(H2,13,18,19)(H,14,15,17).
What are the key properties of 2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide?
2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide has a molecular weight of 310.33 g/mol, XLogP of 0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide is sourced from PubChem (CID 61129046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).