About 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide
2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide (PubChem CID 110479732) has the molecular formula C11H14N4O
and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide.
Molecular Properties
| Compound Name | 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide |
| PubChem CID | 110479732 |
| Molecular Formula | C11H14N4O |
| Molecular Weight | 218.26 g/mol |
| Exact Mass | 218.12 |
| IUPAC Name | 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide |
| SMILES | CN(C)CC(=O)Nc1cccc2[nH]ncc12 |
| InChI | InChI=1S/C11H14N4O/c1-15(2)7-11(16)13-9-4-3-5-10-8(9)6-12-14-10/h3-6H,7H2,1-2H3,(H,12,14)(H,13,16) |
| InChIKey | XNKUDPPUSZOBIC-UHFFFAOYSA-N |
| XLogP | 1.06 |
| TPSA | 61.02 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 218.26 |
| LogP ≤ 5 | 1.06 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide?
The IUPAC name of 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide (CID 110479732) is 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide?
The canonical SMILES for 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide is CN(C)CC(=O)Nc1cccc2[nH]ncc12.
What is the InChIKey of 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide?
The InChIKey is XNKUDPPUSZOBIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-15(2)7-11(16)13-9-4-3-5-10-8(9)6-12-14-10/h3-6H,7H2,1-2H3,(H,12,14)(H,13,16).
What are the key properties of 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide?
2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide has a molecular weight of 218.26 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide is sourced from PubChem (CID 110479732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).