N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide

C5H9N3O2S — CID 126995059

IUPACN-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide
SMILESCc1[nH]ncc1NS(C)(=O)=O
InChIInChI=1S/C5H9N3O2S/c1-4-5(3-6-7-4)8-11(2,9)10/h3,8H,1-2H3,(H,6,7)
InChIKeyHUDXJHKIWDWWDV-UHFFFAOYSA-N
MW175.21 g/mol
LogP0.09
Rot. Bonds2

About N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide

N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide (PubChem CID 126995059) has the molecular formula C5H9N3O2S and a molecular weight of 175.21 g/mol. Its IUPAC name is N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide
PubChem CID126995059
Molecular FormulaC5H9N3O2S
Molecular Weight175.21 g/mol
Exact Mass175.04
IUPAC NameN-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide
SMILESCc1[nH]ncc1NS(C)(=O)=O
InChIInChI=1S/C5H9N3O2S/c1-4-5(3-6-7-4)8-11(2,9)10/h3,8H,1-2H3,(H,6,7)
InChIKeyHUDXJHKIWDWWDV-UHFFFAOYSA-N
XLogP0.09
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.21
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide?
The IUPAC name of N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide (CID 126995059) is N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide.
What is the SMILES notation for N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide?
The canonical SMILES for N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide is Cc1[nH]ncc1NS(C)(=O)=O.
What is the InChIKey of N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide?
The InChIKey is HUDXJHKIWDWWDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O2S/c1-4-5(3-6-7-4)8-11(2,9)10/h3,8H,1-2H3,(H,6,7).
What are the key properties of N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide?
N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide has a molecular weight of 175.21 g/mol, XLogP of 0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide is sourced from PubChem (CID 126995059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).