1-methyl-3-(sulfamoylamino)pyrazole

C4H8N4O2S — CID 112573559

IUPAC1-methyl-3-(sulfamoylamino)pyrazole
SMILESCn1ccc(NS(N)(=O)=O)n1
InChIInChI=1S/C4H8N4O2S/c1-8-3-2-4(6-8)7-11(5,9)10/h2-3H,1H3,(H,6,7)(H2,5,9,10)
InChIKeyHKZWVLYIXRWZPC-UHFFFAOYSA-N
MW176.20 g/mol
LogP-0.96
Rot. Bonds2

About 1-methyl-3-(sulfamoylamino)pyrazole

1-methyl-3-(sulfamoylamino)pyrazole (PubChem CID 112573559) has the molecular formula C4H8N4O2S and a molecular weight of 176.20 g/mol. Its IUPAC name is 1-methyl-3-(sulfamoylamino)pyrazole.

Molecular Properties

Compound Name1-methyl-3-(sulfamoylamino)pyrazole
PubChem CID112573559
Molecular FormulaC4H8N4O2S
Molecular Weight176.20 g/mol
Exact Mass176.04
IUPAC Name1-methyl-3-(sulfamoylamino)pyrazole
SMILESCn1ccc(NS(N)(=O)=O)n1
InChIInChI=1S/C4H8N4O2S/c1-8-3-2-4(6-8)7-11(5,9)10/h2-3H,1H3,(H,6,7)(H2,5,9,10)
InChIKeyHKZWVLYIXRWZPC-UHFFFAOYSA-N
XLogP-0.96
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.20
LogP ≤ 5-0.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,3,4,5,6-pentamethyl-N-(1-methylpyrazol-3-yl)benzenesulfonamide
CID 22209061
4-amino-2,6-dimethyl-N-(1-methylpyrazol-3-yl)benzenesulfonamide
CID 79589626
1-[4-(aminomethyl)phenyl]-N-(1-methylpyrazol-3-yl)methanesulfonamide
CID 60807993
1-methyl-3-[(sulfamoylamino)methyl]pyrazole
CID 112548279
1,3,5-trimethyl-N-(1-methylpyrazol-3-yl)pyrazole-4-sulfonamide
CID 22209066
(1-methylpyrazol-3-yl)hydrazine;trihydrochloride
CID 75525830
N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide
CID 17378925
N-(1-methylpyrazol-3-yl)-1-(propan-2-ylamino)propane-2-sulfonamide
CID 114135422
2-(methylamino)-N-(1-methylpyrazol-3-yl)pyrimidine-5-sulfonamide
CID 55043689
2-hydrazinyl-N-(1-methylpyrazol-3-yl)pyridine-3-sulfonamide
CID 60809974
1-(4-cyanophenyl)-N-(1-methylpyrazol-3-yl)methanesulfonamide
CID 60703867
4-(methylaminomethyl)-N-(1-methylpyrazol-3-yl)benzenesulfonamide
CID 54921777

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(sulfamoylamino)pyrazole?
The IUPAC name of 1-methyl-3-(sulfamoylamino)pyrazole (CID 112573559) is 1-methyl-3-(sulfamoylamino)pyrazole.
What is the SMILES notation for 1-methyl-3-(sulfamoylamino)pyrazole?
The canonical SMILES for 1-methyl-3-(sulfamoylamino)pyrazole is Cn1ccc(NS(N)(=O)=O)n1.
What is the InChIKey of 1-methyl-3-(sulfamoylamino)pyrazole?
The InChIKey is HKZWVLYIXRWZPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4O2S/c1-8-3-2-4(6-8)7-11(5,9)10/h2-3H,1H3,(H,6,7)(H2,5,9,10).
What are the key properties of 1-methyl-3-(sulfamoylamino)pyrazole?
1-methyl-3-(sulfamoylamino)pyrazole has a molecular weight of 176.20 g/mol, XLogP of -0.96, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(sulfamoylamino)pyrazole is sourced from PubChem (CID 112573559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).