4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole

C8H14N4O2S — CID 114810129

IUPAC4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole
SMILESCN(Cc1cn[nH]c1)S(=O)(=O)NC1CC1
InChIInChI=1S/C8H14N4O2S/c1-12(6-7-4-9-10-5-7)15(13,14)11-8-2-3-8/h4-5,8,11H,2-3,6H2,1H3,(H,9,10)
InChIKeyRNQYHPKSYIJLQW-UHFFFAOYSA-N
MW230.29 g/mol
LogP-0.16
Rot. Bonds5

About 4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole

4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole (PubChem CID 114810129) has the molecular formula C8H14N4O2S and a molecular weight of 230.29 g/mol. Its IUPAC name is 4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole.

Molecular Properties

Compound Name4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole
PubChem CID114810129
Molecular FormulaC8H14N4O2S
Molecular Weight230.29 g/mol
Exact Mass230.08
IUPAC Name4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole
SMILESCN(Cc1cn[nH]c1)S(=O)(=O)NC1CC1
InChIInChI=1S/C8H14N4O2S/c1-12(6-7-4-9-10-5-7)15(13,14)11-8-2-3-8/h4-5,8,11H,2-3,6H2,1H3,(H,9,10)
InChIKeyRNQYHPKSYIJLQW-UHFFFAOYSA-N
XLogP-0.16
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole?
The IUPAC name of 4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole (CID 114810129) is 4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole.
What is the SMILES notation for 4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole?
The canonical SMILES for 4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole is CN(Cc1cn[nH]c1)S(=O)(=O)NC1CC1.
What is the InChIKey of 4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole?
The InChIKey is RNQYHPKSYIJLQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2S/c1-12(6-7-4-9-10-5-7)15(13,14)11-8-2-3-8/h4-5,8,11H,2-3,6H2,1H3,(H,9,10).
What are the key properties of 4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole?
4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole has a molecular weight of 230.29 g/mol, XLogP of -0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[cyclopropylsulfamoyl(methyl)amino]methyl]-1H-pyrazole is sourced from PubChem (CID 114810129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).