5-amino-N-phenyl-1H-pyrazole-4-sulfonamide

C9H10N4O2S — CID 60812703

IUPAC5-amino-N-phenyl-1H-pyrazole-4-sulfonamide
SMILESNc1[nH]ncc1S(=O)(=O)Nc1ccccc1
InChIInChI=1S/C9H10N4O2S/c10-9-8(6-11-12-9)16(14,15)13-7-4-2-1-3-5-7/h1-6,13H,(H3,10,11,12)
InChIKeyYUPVEZGXOJISSS-UHFFFAOYSA-N
MW238.27 g/mol
LogP0.79
Rot. Bonds3

About 5-amino-N-phenyl-1H-pyrazole-4-sulfonamide

5-amino-N-phenyl-1H-pyrazole-4-sulfonamide (PubChem CID 60812703) has the molecular formula C9H10N4O2S and a molecular weight of 238.27 g/mol. Its IUPAC name is 5-amino-N-phenyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-N-phenyl-1H-pyrazole-4-sulfonamide
PubChem CID60812703
Molecular FormulaC9H10N4O2S
Molecular Weight238.27 g/mol
Exact Mass238.05
IUPAC Name5-amino-N-phenyl-1H-pyrazole-4-sulfonamide
SMILESNc1[nH]ncc1S(=O)(=O)Nc1ccccc1
InChIInChI=1S/C9H10N4O2S/c10-9-8(6-11-12-9)16(14,15)13-7-4-2-1-3-5-7/h1-6,13H,(H3,10,11,12)
InChIKeyYUPVEZGXOJISSS-UHFFFAOYSA-N
XLogP0.79
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.27
LogP ≤ 50.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-N-(4-chlorophenyl)-1H-pyrazole-4-sulfonamide
CID 60812866
5-amino-N-naphthalen-2-yl-1H-pyrazole-4-sulfonamide
CID 61112730
5-amino-N-(3-sulfamoylphenyl)-1H-pyrazole-4-sulfonamide
CID 60808929
5-amino-N-(3,5-dimethylphenyl)-1H-pyrazole-4-sulfonamide
CID 60815176
5-amino-N-(4-ethoxyphenyl)-1H-pyrazole-4-sulfonamide
CID 60810401
5-amino-N-[4-(cyanomethyl)phenyl]-1H-pyrazole-4-sulfonamide
CID 55056893
5-amino-N-(2,6-dibromophenyl)-1H-pyrazole-4-sulfonamide
CID 107596356
5-amino-N-(2,6-dichlorophenyl)-1H-pyrazole-4-sulfonamide
CID 65468674
5-amino-N-(2-ethylphenyl)-1H-pyrazole-4-sulfonamide
CID 54922893
5-amino-N-[3-(trifluoromethoxy)phenyl]-1H-pyrazole-4-sulfonamide
CID 60808101
5-amino-N-[2-(dimethylamino)phenyl]-1H-pyrazole-4-sulfonamide
CID 106759379
5-amino-N-(2,3-difluorophenyl)-1H-pyrazole-4-sulfonamide
CID 61076416

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-phenyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of 5-amino-N-phenyl-1H-pyrazole-4-sulfonamide (CID 60812703) is 5-amino-N-phenyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for 5-amino-N-phenyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for 5-amino-N-phenyl-1H-pyrazole-4-sulfonamide is Nc1[nH]ncc1S(=O)(=O)Nc1ccccc1.
What is the InChIKey of 5-amino-N-phenyl-1H-pyrazole-4-sulfonamide?
The InChIKey is YUPVEZGXOJISSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2S/c10-9-8(6-11-12-9)16(14,15)13-7-4-2-1-3-5-7/h1-6,13H,(H3,10,11,12).
What are the key properties of 5-amino-N-phenyl-1H-pyrazole-4-sulfonamide?
5-amino-N-phenyl-1H-pyrazole-4-sulfonamide has a molecular weight of 238.27 g/mol, XLogP of 0.79, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-phenyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 60812703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).