N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide

C6H10N4O3S — CID 146846615

IUPACN,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide
SMILESCNC(=O)c1cc(S(N)(=O)=O)nn1C
InChIInChI=1S/C6H10N4O3S/c1-8-6(11)4-3-5(9-10(4)2)14(7,12)13/h3H,1-2H3,(H,8,11)(H2,7,12,13)
InChIKeySHHQCJYXCRZTGR-UHFFFAOYSA-N
MW218.24 g/mol
LogP-1.57
Rot. Bonds2

About N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide

N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide (PubChem CID 146846615) has the molecular formula C6H10N4O3S and a molecular weight of 218.24 g/mol. Its IUPAC name is N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide
PubChem CID146846615
Molecular FormulaC6H10N4O3S
Molecular Weight218.24 g/mol
Exact Mass218.05
IUPAC NameN,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide
SMILESCNC(=O)c1cc(S(N)(=O)=O)nn1C
InChIInChI=1S/C6H10N4O3S/c1-8-6(11)4-3-5(9-10(4)2)14(7,12)13/h3H,1-2H3,(H,8,11)(H2,7,12,13)
InChIKeySHHQCJYXCRZTGR-UHFFFAOYSA-N
XLogP-1.57
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.24
LogP ≤ 5-1.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide?
The IUPAC name of N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide (CID 146846615) is N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide.
What is the SMILES notation for N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide?
The canonical SMILES for N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide is CNC(=O)c1cc(S(N)(=O)=O)nn1C.
What is the InChIKey of N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide?
The InChIKey is SHHQCJYXCRZTGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O3S/c1-8-6(11)4-3-5(9-10(4)2)14(7,12)13/h3H,1-2H3,(H,8,11)(H2,7,12,13).
What are the key properties of N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide?
N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide has a molecular weight of 218.24 g/mol, XLogP of -1.57, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-3-sulfamoylpyrazole-5-carboxamide is sourced from PubChem (CID 146846615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).