4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide

C11H13N5O3S — CID 62083333

IUPAC4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide
SMILESCc1[nH]nc(C(=O)Nc2cccc(S(N)(=O)=O)c2)c1N
InChIInChI=1S/C11H13N5O3S/c1-6-9(12)10(16-15-6)11(17)14-7-3-2-4-8(5-7)20(13,18)19/h2-5H,12H2,1H3,(H,14,17)(H,15,16)(H2,13,18,19)
InChIKeyYYXJDUTUEYJBBC-UHFFFAOYSA-N
MW295.32 g/mol
LogP0.20
Rot. Bonds3

About 4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide

4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide (PubChem CID 62083333) has the molecular formula C11H13N5O3S and a molecular weight of 295.32 g/mol. Its IUPAC name is 4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide
PubChem CID62083333
Molecular FormulaC11H13N5O3S
Molecular Weight295.32 g/mol
Exact Mass295.07
IUPAC Name4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide
SMILESCc1[nH]nc(C(=O)Nc2cccc(S(N)(=O)=O)c2)c1N
InChIInChI=1S/C11H13N5O3S/c1-6-9(12)10(16-15-6)11(17)14-7-3-2-4-8(5-7)20(13,18)19/h2-5H,12H2,1H3,(H,14,17)(H,15,16)(H2,13,18,19)
InChIKeyYYXJDUTUEYJBBC-UHFFFAOYSA-N
XLogP0.20
TPSA143.96 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.32
LogP ≤ 50.20
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-5-methyl-N-(3-methylphenyl)-1H-pyrazole-3-carboxamide
CID 62083149
5-amino-N-(3-sulfamoylphenyl)-1H-pyrazole-4-carboxamide
CID 43337194
4-amino-N-(2,6-diethylphenyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 62082971
2-methyl-N-(3-sulfamoylphenyl)pyridine-3-carboxamide
CID 78950909
4-amino-N-(3,5-dimethoxyphenyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 62082085
4-methyl-N-(3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide
CID 66335294
4-methyl-N-(3-sulfamoylphenyl)-1,3-oxazole-5-carboxamide
CID 79487576
2-amino-3-chloro-N-(3-sulfamoylphenyl)benzamide
CID 115539982
4-amino-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-1H-pyrazole-3-carboxamide
CID 62080864
4-acetamido-N-(3-sulfamoylphenyl)benzamide
CID 4067351
N-(3-sulfamoylphenyl)thiophene-2-carboxamide
CID 2812289
4-amino-5-methyl-N-naphthalen-1-yl-1H-pyrazole-3-carboxamide
CID 62082084

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide (CID 62083333) is 4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide is Cc1[nH]nc(C(=O)Nc2cccc(S(N)(=O)=O)c2)c1N.
What is the InChIKey of 4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide?
The InChIKey is YYXJDUTUEYJBBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O3S/c1-6-9(12)10(16-15-6)11(17)14-7-3-2-4-8(5-7)20(13,18)19/h2-5H,12H2,1H3,(H,14,17)(H,15,16)(H2,13,18,19).
What are the key properties of 4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide?
4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide has a molecular weight of 295.32 g/mol, XLogP of 0.20, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-methyl-N-(3-sulfamoylphenyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62083333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).