N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide

C7H12N4O3S — CID 137499495

IUPACN,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide
SMILESCN(C)C(=O)Cn1ccc(S(N)(=O)=O)n1
InChIInChI=1S/C7H12N4O3S/c1-10(2)7(12)5-11-4-3-6(9-11)15(8,13)14/h3-4H,5H2,1-2H3,(H2,8,13,14)
InChIKeyGRNVVGLDDUJORY-UHFFFAOYSA-N
MW232.26 g/mol
LogP-1.38
Rot. Bonds3

About N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide

N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide (PubChem CID 137499495) has the molecular formula C7H12N4O3S and a molecular weight of 232.26 g/mol. Its IUPAC name is N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide
PubChem CID137499495
Molecular FormulaC7H12N4O3S
Molecular Weight232.26 g/mol
Exact Mass232.06
IUPAC NameN,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide
SMILESCN(C)C(=O)Cn1ccc(S(N)(=O)=O)n1
InChIInChI=1S/C7H12N4O3S/c1-10(2)7(12)5-11-4-3-6(9-11)15(8,13)14/h3-4H,5H2,1-2H3,(H2,8,13,14)
InChIKeyGRNVVGLDDUJORY-UHFFFAOYSA-N
XLogP-1.38
TPSA98.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 5-1.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide?
The IUPAC name of N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide (CID 137499495) is N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide is CN(C)C(=O)Cn1ccc(S(N)(=O)=O)n1.
What is the InChIKey of N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide?
The InChIKey is GRNVVGLDDUJORY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O3S/c1-10(2)7(12)5-11-4-3-6(9-11)15(8,13)14/h3-4H,5H2,1-2H3,(H2,8,13,14).
What are the key properties of N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide?
N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide has a molecular weight of 232.26 g/mol, XLogP of -1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(3-sulfamoylpyrazol-1-yl)acetamide is sourced from PubChem (CID 137499495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).