3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide

C9H14N6O4S2 — CID 61131337

IUPAC3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)Nc1nn(C)cc1S(N)(=O)=O
InChIInChI=1S/C9H14N6O4S2/c1-5-8(6(2)12-11-5)21(18,19)14-9-7(20(10,16)17)4-15(3)13-9/h4H,1-3H3,(H,11,12)(H,13,14)(H2,10,16,17)
InChIKeyNCARFAHHUQKGPG-UHFFFAOYSA-N
MW334.38 g/mol
LogP-0.79
Rot. Bonds4

About 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide

3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide (PubChem CID 61131337) has the molecular formula C9H14N6O4S2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide
PubChem CID61131337
Molecular FormulaC9H14N6O4S2
Molecular Weight334.38 g/mol
Exact Mass334.05
IUPAC Name3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)Nc1nn(C)cc1S(N)(=O)=O
InChIInChI=1S/C9H14N6O4S2/c1-5-8(6(2)12-11-5)21(18,19)14-9-7(20(10,16)17)4-15(3)13-9/h4H,1-3H3,(H,11,12)(H,13,14)(H2,10,16,17)
InChIKeyNCARFAHHUQKGPG-UHFFFAOYSA-N
XLogP-0.79
TPSA152.83 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 5-0.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)-1,3-thiazole-5-sulfonamide
CID 103415785
1-methyl-3-(propan-2-ylsulfonylamino)pyrazole-4-sulfonamide
CID 61132283
1-methyl-3-(pyrrolidin-1-ylsulfonylamino)pyrazole-4-sulfonamide
CID 61131751
N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 113391851
N-(3,5-dimethylphenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 866897
2-methyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)propanamide
CID 61131141
N-(2-amino-4,6-dibromophenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 43550690
3,5-dimethyl-N-pyrimidin-5-yl-1H-pyrazole-4-sulfonamide
CID 113462575
N-(3-amino-2,4-dimethylphenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 60972945
N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-sulfonamide
CID 61131439
N-(4-hydroxyphenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 28785562
3,5-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]-1H-pyrazole-4-sulfonamide
CID 82872630

Frequently Asked Questions

What is the IUPAC name of 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide?
The IUPAC name of 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide (CID 61131337) is 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide.
What is the SMILES notation for 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide?
The canonical SMILES for 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide is Cc1n[nH]c(C)c1S(=O)(=O)Nc1nn(C)cc1S(N)(=O)=O.
What is the InChIKey of 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide?
The InChIKey is NCARFAHHUQKGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N6O4S2/c1-5-8(6(2)12-11-5)21(18,19)14-9-7(20(10,16)17)4-15(3)13-9/h4H,1-3H3,(H,11,12)(H,13,14)(H2,10,16,17).
What are the key properties of 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide?
3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide has a molecular weight of 334.38 g/mol, XLogP of -0.79, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrazole-4-sulfonamide is sourced from PubChem (CID 61131337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).