About 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide
1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide (PubChem CID 175979441) has the molecular formula C18H19N3O3S
and a molecular weight of 357.44 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide.
Molecular Properties
| Compound Name | 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide |
| PubChem CID | 175979441 |
| Molecular Formula | C18H19N3O3S |
| Molecular Weight | 357.44 g/mol |
| Exact Mass | 357.11 |
| IUPAC Name | 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide |
| SMILES | COc1ccc(CNS(=O)(=O)c2ccc3c(C4CC4)ncn3c2)cc1 |
| InChI | InChI=1S/C18H19N3O3S/c1-24-15-6-2-13(3-7-15)10-20-25(22,23)16-8-9-17-18(14-4-5-14)19-12-21(17)11-16/h2-3,6-9,11-12,14,20H,4-5,10H2,1H3 |
| InChIKey | GHQJJQQSJNJPJB-UHFFFAOYSA-N |
| XLogP | 2.70 |
| TPSA | 72.70 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 357.44 |
| LogP ≤ 5 | 2.70 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide?
The IUPAC name of 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide (CID 175979441) is 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide.
What is the SMILES notation for 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide?
The canonical SMILES for 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide is COc1ccc(CNS(=O)(=O)c2ccc3c(C4CC4)ncn3c2)cc1.
What is the InChIKey of 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide?
The InChIKey is GHQJJQQSJNJPJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3S/c1-24-15-6-2-13(3-7-15)10-20-25(22,23)16-8-9-17-18(14-4-5-14)19-12-21(17)11-16/h2-3,6-9,11-12,14,20H,4-5,10H2,1H3.
What are the key properties of 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide?
1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide has a molecular weight of 357.44 g/mol, XLogP of 2.70, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-6-sulfonamide is sourced from PubChem (CID 175979441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).