5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide

C6H13N5O4S2 — CID 114174781

IUPAC5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide
SMILESCNS(=O)(=O)CCNS(=O)(=O)c1cn[nH]c1N
InChIInChI=1S/C6H13N5O4S2/c1-8-16(12,13)3-2-10-17(14,15)5-4-9-11-6(5)7/h4,8,10H,2-3H2,1H3,(H3,7,9,11)
InChIKeyOMAJHIGMPNNYAA-UHFFFAOYSA-N
MW283.34 g/mol
LogP-2.18
Rot. Bonds6

About 5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide

5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide (PubChem CID 114174781) has the molecular formula C6H13N5O4S2 and a molecular weight of 283.34 g/mol. Its IUPAC name is 5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide
PubChem CID114174781
Molecular FormulaC6H13N5O4S2
Molecular Weight283.34 g/mol
Exact Mass283.04
IUPAC Name5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide
SMILESCNS(=O)(=O)CCNS(=O)(=O)c1cn[nH]c1N
InChIInChI=1S/C6H13N5O4S2/c1-8-16(12,13)3-2-10-17(14,15)5-4-9-11-6(5)7/h4,8,10H,2-3H2,1H3,(H3,7,9,11)
InChIKeyOMAJHIGMPNNYAA-UHFFFAOYSA-N
XLogP-2.18
TPSA147.04 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 5-2.18
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-N-(2,2-dimethylpropyl)-1H-pyrazole-4-sulfonamide
CID 61168845
5-amino-N-[2-(4-fluorophenyl)ethyl]-1H-pyrazole-4-sulfonamide
CID 60808924
5-amino-N-(5-hydroxypentyl)-1H-pyrazole-4-sulfonamide
CID 107316396
5-amino-N-(3-ethoxypropyl)-1H-pyrazole-4-sulfonamide
CID 60813356
5-amino-N-(2-methyl-2-methylsulfonylpropyl)-1H-pyrazole-4-sulfonamide
CID 79552513
5-amino-N-(2-methoxy-2-methylpropyl)-1H-pyrazole-4-sulfonamide
CID 104758545
3-amino-2,4,6-trimethyl-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
CID 106333290
5-amino-N-(2-ethyl-2-hydroxybutyl)-1H-pyrazole-4-sulfonamide
CID 65102925
5-amino-2-fluoro-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
CID 106333323
5-amino-N-[3-(1H-1,2,4-triazol-5-yl)propyl]-1H-pyrazole-4-sulfonamide
CID 64517232
2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-N-propylacetamide
CID 60809282
2-amino-5-bromo-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
CID 106333410

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide?
The IUPAC name of 5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide (CID 114174781) is 5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for 5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide?
The canonical SMILES for 5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide is CNS(=O)(=O)CCNS(=O)(=O)c1cn[nH]c1N.
What is the InChIKey of 5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide?
The InChIKey is OMAJHIGMPNNYAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N5O4S2/c1-8-16(12,13)3-2-10-17(14,15)5-4-9-11-6(5)7/h4,8,10H,2-3H2,1H3,(H3,7,9,11).
What are the key properties of 5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide?
5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide has a molecular weight of 283.34 g/mol, XLogP of -2.18, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 114174781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).