N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide

C6H10N4O3S — CID 47267378

IUPACN-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide
SMILESCNC(=O)CNS(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C6H10N4O3S/c1-7-6(11)4-10-14(12,13)5-2-8-9-3-5/h2-3,10H,4H2,1H3,(H,7,11)(H,8,9)
InChIKeyKAWUMXILAKBEIF-UHFFFAOYSA-N
MW218.24 g/mol
LogP-1.57
Rot. Bonds4

About N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide

N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide (PubChem CID 47267378) has the molecular formula C6H10N4O3S and a molecular weight of 218.24 g/mol. Its IUPAC name is N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide.

Molecular Properties

Compound NameN-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide
PubChem CID47267378
Molecular FormulaC6H10N4O3S
Molecular Weight218.24 g/mol
Exact Mass218.05
IUPAC NameN-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide
SMILESCNC(=O)CNS(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C6H10N4O3S/c1-7-6(11)4-10-14(12,13)5-2-8-9-3-5/h2-3,10H,4H2,1H3,(H,7,11)(H,8,9)
InChIKeyKAWUMXILAKBEIF-UHFFFAOYSA-N
XLogP-1.57
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.24
LogP ≤ 5-1.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide?
The IUPAC name of N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide (CID 47267378) is N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide.
What is the SMILES notation for N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide?
The canonical SMILES for N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide is CNC(=O)CNS(=O)(=O)c1cn[nH]c1.
What is the InChIKey of N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide?
The InChIKey is KAWUMXILAKBEIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O3S/c1-7-6(11)4-10-14(12,13)5-2-8-9-3-5/h2-3,10H,4H2,1H3,(H,7,11)(H,8,9).
What are the key properties of N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide?
N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide has a molecular weight of 218.24 g/mol, XLogP of -1.57, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1H-pyrazol-4-ylsulfonylamino)acetamide is sourced from PubChem (CID 47267378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).