2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide

C8H14N4O3S — CID 61131141

IUPAC2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide
SMILESCC(C)C(=O)Nc1nn(C)cc1S(N)(=O)=O
InChIInChI=1S/C8H14N4O3S/c1-5(2)8(13)10-7-6(16(9,14)15)4-12(3)11-7/h4-5H,1-3H3,(H2,9,14,15)(H,10,11,13)
InChIKeyPMDZUNNMKZXTCX-UHFFFAOYSA-N
MW246.29 g/mol
LogP-0.34
Rot. Bonds3

About 2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide

2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide (PubChem CID 61131141) has the molecular formula C8H14N4O3S and a molecular weight of 246.29 g/mol. Its IUPAC name is 2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide
PubChem CID61131141
Molecular FormulaC8H14N4O3S
Molecular Weight246.29 g/mol
Exact Mass246.08
IUPAC Name2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide
SMILESCC(C)C(=O)Nc1nn(C)cc1S(N)(=O)=O
InChIInChI=1S/C8H14N4O3S/c1-5(2)8(13)10-7-6(16(9,14)15)4-12(3)11-7/h4-5H,1-3H3,(H2,9,14,15)(H,10,11,13)
InChIKeyPMDZUNNMKZXTCX-UHFFFAOYSA-N
XLogP-0.34
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-3-(propan-2-ylsulfonylamino)pyrazole-4-sulfonamide
CID 61132283
1-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)pyrazole-4-carboxamide
CID 61132038
3,5-difluoro-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
CID 61131914
N-(1-methyl-4-sulfamoylpyrazol-3-yl)piperidine-1-carboxamide
CID 79155036
1-(4-methylphenyl)-3-(1-methyl-4-sulfamoylpyrazol-3-yl)urea
CID 61132750
1,5-dimethyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)pyrazole-3-carboxamide
CID 114219136
1-(4-fluorophenyl)-3-(1-methyl-4-sulfamoylpyrazol-3-yl)urea
CID 61132441
N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-carboxamide
CID 79152077
4-bromo-1-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)pyrrole-2-carboxamide
CID 61131380
N-(1-methyl-4-sulfamoylpyrazol-3-yl)furan-3-carboxamide
CID 61131275
1-butyl-3-(1-methyl-4-sulfamoylpyrazol-3-yl)urea
CID 61132638
2,4-dimethyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
CID 61129233

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide?
The IUPAC name of 2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide (CID 61131141) is 2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide?
The canonical SMILES for 2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide is CC(C)C(=O)Nc1nn(C)cc1S(N)(=O)=O.
What is the InChIKey of 2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide?
The InChIKey is PMDZUNNMKZXTCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O3S/c1-5(2)8(13)10-7-6(16(9,14)15)4-12(3)11-7/h4-5H,1-3H3,(H2,9,14,15)(H,10,11,13).
What are the key properties of 2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide?
2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide has a molecular weight of 246.29 g/mol, XLogP of -0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide is sourced from PubChem (CID 61131141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).