4-amino-1-methylpyrazole-3-sulfonamide

C4H8N4O2S — CID 122673402

IUPAC4-amino-1-methylpyrazole-3-sulfonamide
SMILESCn1cc(N)c(S(N)(=O)=O)n1
InChIInChI=1S/C4H8N4O2S/c1-8-2-3(5)4(7-8)11(6,9)10/h2H,5H2,1H3,(H2,6,9,10)
InChIKeySNBCYBOOFHCQGI-UHFFFAOYSA-N
MW176.20 g/mol
LogP-1.35
Rot. Bonds1

About 4-amino-1-methylpyrazole-3-sulfonamide

4-amino-1-methylpyrazole-3-sulfonamide (PubChem CID 122673402) has the molecular formula C4H8N4O2S and a molecular weight of 176.20 g/mol. Its IUPAC name is 4-amino-1-methylpyrazole-3-sulfonamide.

Molecular Properties

Compound Name4-amino-1-methylpyrazole-3-sulfonamide
PubChem CID122673402
Molecular FormulaC4H8N4O2S
Molecular Weight176.20 g/mol
Exact Mass176.04
IUPAC Name4-amino-1-methylpyrazole-3-sulfonamide
SMILESCn1cc(N)c(S(N)(=O)=O)n1
InChIInChI=1S/C4H8N4O2S/c1-8-2-3(5)4(7-8)11(6,9)10/h2H,5H2,1H3,(H2,6,9,10)
InChIKeySNBCYBOOFHCQGI-UHFFFAOYSA-N
XLogP-1.35
TPSA104.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.20
LogP ≤ 5-1.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-4-propan-2-ylpyrazole-3-sulfonamide
CID 134247755
hydrogen sulfate;hydron;1-methylpyrazole-3,4-diamine
CID 173373687
3-chloro-1-methylpyrazol-4-amine;hydrochloride
CID 154814564
3-N,1-dimethyl-3-N-(2-methylsulfonylethyl)pyrazole-3,4-diamine
CID 103078693
4-amino-1-methyl-N-[(4-sulfamoylphenyl)methyl]pyrazole-3-carboxamide
CID 65354656
2-(1-methyl-4-nitropyrazol-3-yl)sulfonylethanesulfonamide
CID 103080489
1-methyl-3-pyrrolidin-1-ylpyrazol-4-amine;dihydrochloride
CID 102565516
3-amino-4-[(1,3-dimethylpyrazol-4-yl)amino]benzenesulfonamide
CID 102803689
1-methylimidazole-4-sulfonamide;hydrochloride
CID 141278244
1-methyl-3-(trifluoromethyl)pyrazol-4-amine;hydrochloride
CID 75480753
3-(difluoromethyl)-1-methylpyrazol-4-amine;hydrochloride
CID 121215468
3-amino-N-cyclopropyl-1-methylpyrazole-4-sulfonamide
CID 60814194

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-methylpyrazole-3-sulfonamide?
The IUPAC name of 4-amino-1-methylpyrazole-3-sulfonamide (CID 122673402) is 4-amino-1-methylpyrazole-3-sulfonamide.
What is the SMILES notation for 4-amino-1-methylpyrazole-3-sulfonamide?
The canonical SMILES for 4-amino-1-methylpyrazole-3-sulfonamide is Cn1cc(N)c(S(N)(=O)=O)n1.
What is the InChIKey of 4-amino-1-methylpyrazole-3-sulfonamide?
The InChIKey is SNBCYBOOFHCQGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4O2S/c1-8-2-3(5)4(7-8)11(6,9)10/h2H,5H2,1H3,(H2,6,9,10).
What are the key properties of 4-amino-1-methylpyrazole-3-sulfonamide?
4-amino-1-methylpyrazole-3-sulfonamide has a molecular weight of 176.20 g/mol, XLogP of -1.35, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-methylpyrazole-3-sulfonamide is sourced from PubChem (CID 122673402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).