5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine

C8H9N3O2S2 — CID 51109215

IUPAC5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine
SMILESCc1cc(N)n(S(=O)(=O)c2cccs2)n1
InChIInChI=1S/C8H9N3O2S2/c1-6-5-7(9)11(10-6)15(12,13)8-3-2-4-14-8/h2-5H,9H2,1H3
InChIKeyXYJTWIPNRHPBSO-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.07
Rot. Bonds2

About 5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine

5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine (PubChem CID 51109215) has the molecular formula C8H9N3O2S2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine.

Molecular Properties

Compound Name5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine
PubChem CID51109215
Molecular FormulaC8H9N3O2S2
Molecular Weight243.31 g/mol
Exact Mass243.01
IUPAC Name5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine
SMILESCc1cc(N)n(S(=O)(=O)c2cccs2)n1
InChIInChI=1S/C8H9N3O2S2/c1-6-5-7(9)11(10-6)15(12,13)8-3-2-4-14-8/h2-5H,9H2,1H3
InChIKeyXYJTWIPNRHPBSO-UHFFFAOYSA-N
XLogP1.07
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine?
The IUPAC name of 5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine (CID 51109215) is 5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine.
What is the SMILES notation for 5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine?
The canonical SMILES for 5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine is Cc1cc(N)n(S(=O)(=O)c2cccs2)n1.
What is the InChIKey of 5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine?
The InChIKey is XYJTWIPNRHPBSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O2S2/c1-6-5-7(9)11(10-6)15(12,13)8-3-2-4-14-8/h2-5H,9H2,1H3.
What are the key properties of 5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine?
5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine has a molecular weight of 243.31 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-thiophen-2-ylsulfonylpyrazol-3-amine is sourced from PubChem (CID 51109215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).