2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide

C8H11N5O2S — CID 63000547

IUPAC2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2ccn(C)n2)[nH]1
InChIInChI=1S/C8H11N5O2S/c1-6-9-5-8(10-6)16(14,15)12-7-3-4-13(2)11-7/h3-5H,1-2H3,(H,9,10)(H,11,12)
InChIKeyGWIFJVZEEJFGQE-UHFFFAOYSA-N
MW241.28 g/mol
LogP0.25
Rot. Bonds3

About 2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide

2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide (PubChem CID 63000547) has the molecular formula C8H11N5O2S and a molecular weight of 241.28 g/mol. Its IUPAC name is 2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide
PubChem CID63000547
Molecular FormulaC8H11N5O2S
Molecular Weight241.28 g/mol
Exact Mass241.06
IUPAC Name2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2ccn(C)n2)[nH]1
InChIInChI=1S/C8H11N5O2S/c1-6-9-5-8(10-6)16(14,15)12-7-3-4-13(2)11-7/h3-5H,1-2H3,(H,9,10)(H,11,12)
InChIKeyGWIFJVZEEJFGQE-UHFFFAOYSA-N
XLogP0.25
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.28
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-cyclopentylpyrazol-3-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide
CID 56795167
2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide
CID 62998508
N-(2-cyclohexylpyrazol-3-yl)-2-methyl-1H-imidazole-5-sulfonamide
CID 75369302
N-(2-(1H-imidazo[1,2-b]pyrazol-1-yl)ethyl)-1-methyl-1H-imidazole-4-sulfonamide
CID 76148332
N-[(1S)-1-(5-methyl-1H-imidazol-2-yl)propyl]-1-propylpyrazole-4-sulfonamide
CID 164633988
N-[4-chloro-1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-2-methyl-1H-imidazole-5-sulfonamide
CID 126828840
N-(3,3-difluoro-2-pyrazol-1-ylpropyl)-1H-imidazole-5-sulfonamide
CID 167826184
1-(2-Methylpyrazol-3-yl)imidazole-2-sulfonamide
CID 14252766
5-N-(1H-imidazol-5-ylsulfanyl)-3-N-methyl-1H-pyrazole-3,5-diamine
CID 123235187
1-[(1-Methylimidazol-2-yl)methyl]pyrazole-3-sulfonamide
CID 137512309
5-chloro-1-methyl-N-(2-propan-2-ylpyrazol-3-yl)imidazole-4-sulfonamide
CID 43456000
5-amino-N-(1-imidazol-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
CID 54958616

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide?
The IUPAC name of 2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide (CID 63000547) is 2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for 2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for 2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide is Cc1ncc(S(=O)(=O)Nc2ccn(C)n2)[nH]1.
What is the InChIKey of 2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide?
The InChIKey is GWIFJVZEEJFGQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O2S/c1-6-9-5-8(10-6)16(14,15)12-7-3-4-13(2)11-7/h3-5H,1-2H3,(H,9,10)(H,11,12).
What are the key properties of 2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide?
2-methyl-N-(1-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide has a molecular weight of 241.28 g/mol, XLogP of 0.25, 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-methylpyrazol-3-yl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 63000547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).