1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide

C10H15N5O2S — CID 62066067

IUPAC1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide
SMILESCCn1cc(S(=O)(=O)NCc2cn[nH]c2)nc1C
InChIInChI=1S/C10H15N5O2S/c1-3-15-7-10(14-8(15)2)18(16,17)13-6-9-4-11-12-5-9/h4-5,7,13H,3,6H2,1-2H3,(H,11,12)
InChIKeyONYALIOPDPQSOF-UHFFFAOYSA-N
MW269.33 g/mol
LogP0.41
Rot. Bonds5

About 1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide

1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide (PubChem CID 62066067) has the molecular formula C10H15N5O2S and a molecular weight of 269.33 g/mol. Its IUPAC name is 1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide.

Molecular Properties

Compound Name1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide
PubChem CID62066067
Molecular FormulaC10H15N5O2S
Molecular Weight269.33 g/mol
Exact Mass269.09
IUPAC Name1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide
SMILESCCn1cc(S(=O)(=O)NCc2cn[nH]c2)nc1C
InChIInChI=1S/C10H15N5O2S/c1-3-15-7-10(14-8(15)2)18(16,17)13-6-9-4-11-12-5-9/h4-5,7,13H,3,6H2,1-2H3,(H,11,12)
InChIKeyONYALIOPDPQSOF-UHFFFAOYSA-N
XLogP0.41
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.33
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-{[1-(1H-imidazol-1-ylmethyl)cyclopropyl]methyl}-1H-pyrazole-4-sulfonamide
CID 122558098
1-[[1-(2,2-Difluoroethyl)pyrazol-4-yl]methyl]-4-(1,2-dimethylimidazol-4-yl)sulfonylpiperazine
CID 126799700
1,2-dimethyl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]imidazole-4-sulfonamide
CID 146132317
1-[(1-ethyl-2-methyl-1H-imidazol-4-yl)sulfonyl]-4-[(1-methyl-1H-pyrazol-4-yl)sulfonyl]-1,4-diazepane
CID 86266992
5-chloro-1-methyl-N-(1H-pyrazol-4-yl)imidazole-4-sulfonamide
CID 43532794
1,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylimidazole-4-sulfonamide
CID 47092489
N-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-4-sulfonamide
CID 47268220
N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-1H-pyrazole-4-sulfonamide
CID 47291822
N-(2-imidazol-1-ylethyl)-1H-pyrazole-4-sulfonamide
CID 47364355
5-chloro-1-methyl-N-[(1-methylpyrazol-4-yl)methyl]imidazole-4-sulfonamide
CID 47364480
N-(3-imidazol-1-ylpropyl)-1H-pyrazole-4-sulfonamide
CID 54937214
5-amino-N-(1-imidazol-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
CID 54958616

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide?
The IUPAC name of 1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide (CID 62066067) is 1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide.
What is the SMILES notation for 1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide?
The canonical SMILES for 1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide is CCn1cc(S(=O)(=O)NCc2cn[nH]c2)nc1C.
What is the InChIKey of 1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide?
The InChIKey is ONYALIOPDPQSOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2S/c1-3-15-7-10(14-8(15)2)18(16,17)13-6-9-4-11-12-5-9/h4-5,7,13H,3,6H2,1-2H3,(H,11,12).
What are the key properties of 1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide?
1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide has a molecular weight of 269.33 g/mol, XLogP of 0.41, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-methyl-N-(1H-pyrazol-4-ylmethyl)imidazole-4-sulfonamide is sourced from PubChem (CID 62066067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).