N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide

C6H10N4O3S — CID 43582888

IUPACN-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide
SMILESNS(=O)(=O)CCNC(=O)c1cn[nH]c1
InChIInChI=1S/C6H10N4O3S/c7-14(12,13)2-1-8-6(11)5-3-9-10-4-5/h3-4H,1-2H2,(H,8,11)(H,9,10)(H2,7,12,13)
InChIKeyBQPMTATUUMKHQB-UHFFFAOYSA-N
MW218.24 g/mol
LogP-1.57
Rot. Bonds4

About N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide

N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide (PubChem CID 43582888) has the molecular formula C6H10N4O3S and a molecular weight of 218.24 g/mol. Its IUPAC name is N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide
PubChem CID43582888
Molecular FormulaC6H10N4O3S
Molecular Weight218.24 g/mol
Exact Mass218.05
IUPAC NameN-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide
SMILESNS(=O)(=O)CCNC(=O)c1cn[nH]c1
InChIInChI=1S/C6H10N4O3S/c7-14(12,13)2-1-8-6(11)5-3-9-10-4-5/h3-4H,1-2H2,(H,8,11)(H,9,10)(H2,7,12,13)
InChIKeyBQPMTATUUMKHQB-UHFFFAOYSA-N
XLogP-1.57
TPSA117.94 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-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide (CID 43582888) is N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide is NS(=O)(=O)CCNC(=O)c1cn[nH]c1.
What is the InChIKey of N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide?
The InChIKey is BQPMTATUUMKHQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O3S/c7-14(12,13)2-1-8-6(11)5-3-9-10-4-5/h3-4H,1-2H2,(H,8,11)(H,9,10)(H2,7,12,13).
What are the key properties of N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide?
N-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide 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-(2-sulfamoylethyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 43582888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).