About N-methyl-1H-indazole-5-carboxamide
N-methyl-1H-indazole-5-carboxamide (PubChem CID 22934041) has the molecular formula C9H9N3O
and a molecular weight of 175.19 g/mol. Its IUPAC name is N-methyl-1H-indazole-5-carboxamide.
Molecular Properties
| Compound Name | N-methyl-1H-indazole-5-carboxamide |
| PubChem CID | 22934041 |
| Molecular Formula | C9H9N3O |
| Molecular Weight | 175.19 g/mol |
| Exact Mass | 175.07 |
| IUPAC Name | N-methyl-1H-indazole-5-carboxamide |
| SMILES | CNC(=O)c1ccc2[nH]ncc2c1 |
| InChI | InChI=1S/C9H9N3O/c1-10-9(13)6-2-3-8-7(4-6)5-11-12-8/h2-5H,1H3,(H,10,13)(H,11,12) |
| InChIKey | CSTBSTICBFYTGJ-UHFFFAOYSA-N |
| XLogP | 0.92 |
| TPSA | 57.78 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 175.19 |
| LogP ≤ 5 | 0.92 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-methyl-1H-indazole-5-carboxamide?
The IUPAC name of N-methyl-1H-indazole-5-carboxamide (CID 22934041) is N-methyl-1H-indazole-5-carboxamide.
What is the SMILES notation for N-methyl-1H-indazole-5-carboxamide?
The canonical SMILES for N-methyl-1H-indazole-5-carboxamide is CNC(=O)c1ccc2[nH]ncc2c1.
What is the InChIKey of N-methyl-1H-indazole-5-carboxamide?
The InChIKey is CSTBSTICBFYTGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c1-10-9(13)6-2-3-8-7(4-6)5-11-12-8/h2-5H,1H3,(H,10,13)(H,11,12).
What are the key properties of N-methyl-1H-indazole-5-carboxamide?
N-methyl-1H-indazole-5-carboxamide has a molecular weight of 175.19 g/mol, XLogP of 0.92, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1H-indazole-5-carboxamide is sourced from PubChem (CID 22934041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).