N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide

C8H15N5O5S2 — CID 61131439

IUPACN-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide
SMILESCn1cc(S(N)(=O)=O)c(NS(=O)(=O)N2CCOCC2)n1
InChIInChI=1S/C8H15N5O5S2/c1-12-6-7(19(9,14)15)8(10-12)11-20(16,17)13-2-4-18-5-3-13/h6H,2-5H2,1H3,(H,10,11)(H2,9,14,15)
InChIKeyITPHUXJCLCDXOG-UHFFFAOYSA-N
MW325.37 g/mol
LogP-1.94
Rot. Bonds4

About N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide

N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide (PubChem CID 61131439) has the molecular formula C8H15N5O5S2 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide
PubChem CID61131439
Molecular FormulaC8H15N5O5S2
Molecular Weight325.37 g/mol
Exact Mass325.05
IUPAC NameN-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide
SMILESCn1cc(S(N)(=O)=O)c(NS(=O)(=O)N2CCOCC2)n1
InChIInChI=1S/C8H15N5O5S2/c1-12-6-7(19(9,14)15)8(10-12)11-20(16,17)13-2-4-18-5-3-13/h6H,2-5H2,1H3,(H,10,11)(H2,9,14,15)
InChIKeyITPHUXJCLCDXOG-UHFFFAOYSA-N
XLogP-1.94
TPSA136.62 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 5-1.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

1-methyl-3-(pyrrolidin-1-ylsulfonylamino)pyrazole-4-sulfonamide
CID 61131751
N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-carboxamide
CID 79152077
1-methyl-3-(propan-2-ylsulfonylamino)pyrazole-4-sulfonamide
CID 61132283
N-(1-methyl-4-sulfamoylpyrazol-3-yl)piperidine-1-carboxamide
CID 79155036
N-(5-amino-3-methyl-2-pyridinyl)morpholine-4-sulfonamide
CID 112555542
N-(1-methyl-4-sulfamoylpyrazol-3-yl)-2-(oxolan-2-yl)acetamide
CID 65159312
3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide
CID 61131337
2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)-1,3-thiazole-5-sulfonamide
CID 103415785
2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide
CID 61131141
1-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)pyrazole-4-carboxamide
CID 61132038
N-(4-hydroxyphenyl)morpholine-4-sulfonamide
CID 21238314
N-(4-fluorophenyl)morpholine-4-sulfonamide
CID 2978606

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide?
The IUPAC name of N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide (CID 61131439) is N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide.
What is the SMILES notation for N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide?
The canonical SMILES for N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide is Cn1cc(S(N)(=O)=O)c(NS(=O)(=O)N2CCOCC2)n1.
What is the InChIKey of N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide?
The InChIKey is ITPHUXJCLCDXOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O5S2/c1-12-6-7(19(9,14)15)8(10-12)11-20(16,17)13-2-4-18-5-3-13/h6H,2-5H2,1H3,(H,10,11)(H2,9,14,15).
What are the key properties of N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide?
N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide has a molecular weight of 325.37 g/mol, XLogP of -1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide is sourced from PubChem (CID 61131439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).