About N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide
N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide (PubChem CID 166234786) has the molecular formula C15H15N5O3S
and a molecular weight of 345.38 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide.
Molecular Properties
| Compound Name | N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide |
| PubChem CID | 166234786 |
| Molecular Formula | C15H15N5O3S |
| Molecular Weight | 345.38 g/mol |
| Exact Mass | 345.09 |
| IUPAC Name | N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide |
| SMILES | COc1ccc(NS(=O)(=O)c2cnn(-c3cc(C)ccn3)c2)cn1 |
| InChI | InChI=1S/C15H15N5O3S/c1-11-5-6-16-14(7-11)20-10-13(9-18-20)24(21,22)19-12-3-4-15(23-2)17-8-12/h3-10,19H,1-2H3 |
| InChIKey | LYAAURWXJNZTKB-UHFFFAOYSA-N |
| XLogP | 1.78 |
| TPSA | 99.00 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 345.38 |
| LogP ≤ 5 | 1.78 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 7 |
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Frequently Asked Questions
What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide (CID 166234786) is N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide is COc1ccc(NS(=O)(=O)c2cnn(-c3cc(C)ccn3)c2)cn1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide?
The InChIKey is LYAAURWXJNZTKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O3S/c1-11-5-6-16-14(7-11)20-10-13(9-18-20)24(21,22)19-12-3-4-15(23-2)17-8-12/h3-10,19H,1-2H3.
What are the key properties of N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide?
N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide has a molecular weight of 345.38 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-1-(4-methyl-2-pyridinyl)pyrazole-4-sulfonamide is sourced from PubChem (CID 166234786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).