1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide

C10H12N4O2S — CID 17375852

IUPAC1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide
SMILESCc1nn(C)cc1S(=O)(=O)Nc1ccccn1
InChIInChI=1S/C10H12N4O2S/c1-8-9(7-14(2)12-8)17(15,16)13-10-5-3-4-6-11-10/h3-7H,1-2H3,(H,11,13)
InChIKeyZBYATZMLXYJMGI-UHFFFAOYSA-N
MW252.30 g/mol
LogP0.92
Rot. Bonds3

About 1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide

1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide (PubChem CID 17375852) has the molecular formula C10H12N4O2S and a molecular weight of 252.30 g/mol. Its IUPAC name is 1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide
PubChem CID17375852
Molecular FormulaC10H12N4O2S
Molecular Weight252.30 g/mol
Exact Mass252.07
IUPAC Name1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide
SMILESCc1nn(C)cc1S(=O)(=O)Nc1ccccn1
InChIInChI=1S/C10H12N4O2S/c1-8-9(7-14(2)12-8)17(15,16)13-10-5-3-4-6-11-10/h3-7H,1-2H3,(H,11,13)
InChIKeyZBYATZMLXYJMGI-UHFFFAOYSA-N
XLogP0.92
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.30
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1,3-dimethyl-N-phenylpyrazole-4-sulfonamide
CID 17377259
2,3,4,5-tetramethyl-N-pyridin-2-ylbenzenesulfonamide
CID 16644704
2-[(1,3-dimethylpyrazol-4-yl)sulfonylamino]benzamide
CID 17371559
N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole-4-sulfonamide
CID 22202446
N-(2-methoxy-5-phenylphenyl)-1,3-dimethylpyrazole-4-sulfonamide
CID 16677699
2-bromo-4-methyl-N-pyridin-2-ylbenzenesulfonamide
CID 60824838
N-(4-ethylphenyl)-1,3-dimethylpyrazole-4-sulfonamide
CID 22773854
1,3-dimethyl-N-(4-sulfamoylphenyl)pyrazole-4-sulfonamide
CID 22774819
2-chloro-N-pyridin-2-ylpyridine-3-sulfonamide
CID 43415000
2,3,5,6-tetramethyl-N-pyridin-2-ylbenzenesulfonamide
CID 2147472
N-[4-(tert-butylsulfamoyl)phenyl]-1,3-dimethylpyrazole-4-sulfonamide
CID 17383073
1,3-dimethyl-N-(1,2,4-triazol-4-yl)pyrazole-4-sulfonamide
CID 19683372

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide?
The IUPAC name of 1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide (CID 17375852) is 1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide.
What is the SMILES notation for 1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide?
The canonical SMILES for 1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide is Cc1nn(C)cc1S(=O)(=O)Nc1ccccn1.
What is the InChIKey of 1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide?
The InChIKey is ZBYATZMLXYJMGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2S/c1-8-9(7-14(2)12-8)17(15,16)13-10-5-3-4-6-11-10/h3-7H,1-2H3,(H,11,13).
What are the key properties of 1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide?
1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide has a molecular weight of 252.30 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide is sourced from PubChem (CID 17375852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).