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

C10H15N5O2S — CID 62998508

IUPAC2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2ccnn2C(C)C)[nH]1
InChIInChI=1S/C10H15N5O2S/c1-7(2)15-9(4-5-12-15)14-18(16,17)10-6-11-8(3)13-10/h4-7,14H,1-3H3,(H,11,13)
InChIKeyDZJBITYAKOHGGO-UHFFFAOYSA-N
MW269.33 g/mol
LogP1.30
Rot. Bonds4

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

2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide (PubChem CID 62998508) has the molecular formula C10H15N5O2S and a molecular weight of 269.33 g/mol. Its IUPAC name is 2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide
PubChem CID62998508
Molecular FormulaC10H15N5O2S
Molecular Weight269.33 g/mol
Exact Mass269.09
IUPAC Name2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2ccnn2C(C)C)[nH]1
InChIInChI=1S/C10H15N5O2S/c1-7(2)15-9(4-5-12-15)14-18(16,17)10-6-11-8(3)13-10/h4-7,14H,1-3H3,(H,11,13)
InChIKeyDZJBITYAKOHGGO-UHFFFAOYSA-N
XLogP1.30
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.33
LogP ≤ 51.30
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
N-(2-cyclohexylpyrazol-3-yl)-2-methyl-1H-imidazole-5-sulfonamide
CID 75369302
N-[(1S)-1-(5-methyl-1H-imidazol-2-yl)propyl]-1-propylpyrazole-4-sulfonamide
CID 164633988
1-cyclopentyl-N-[(1S)-1-(5-methyl-1H-imidazol-2-yl)propyl]pyrazole-4-sulfonamide
CID 164640749
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
N-(2-(1H-imidazo[1,2-b]pyrazol-1-yl)ethyl)-1-methyl-1H-imidazole-4-sulfonamide
CID 76148332
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-chloro-1-methyl-N-(1-pyrazol-1-ylpropan-2-yl)imidazole-4-sulfonamide
CID 45821827
5-chloro-1-methyl-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]imidazole-4-sulfonamide
CID 51891631

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide?
The IUPAC name of 2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide (CID 62998508) is 2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for 2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for 2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide is Cc1ncc(S(=O)(=O)Nc2ccnn2C(C)C)[nH]1.
What is the InChIKey of 2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide?
The InChIKey is DZJBITYAKOHGGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2S/c1-7(2)15-9(4-5-12-15)14-18(16,17)10-6-11-8(3)13-10/h4-7,14H,1-3H3,(H,11,13).
What are the key properties of 2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide?
2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide has a molecular weight of 269.33 g/mol, XLogP of 1.30, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 62998508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).