About 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide
5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide (PubChem CID 115489725) has the molecular formula C10H11N5
and a molecular weight of 201.23 g/mol. Its IUPAC name is 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide.
Molecular Properties
| Compound Name | 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide |
| PubChem CID | 115489725 |
| Molecular Formula | C10H11N5 |
| Molecular Weight | 201.23 g/mol |
| Exact Mass | 201.10 |
| IUPAC Name | 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide |
| SMILES | [H]/N=C(\N)c1ccc(-n2ccnc2C)cn1 |
| InChI | InChI=1S/C10H11N5/c1-7-13-4-5-15(7)8-2-3-9(10(11)12)14-6-8/h2-6H,1H3,(H3,11,12) |
| InChIKey | DWQZBBJCWLJCPT-UHFFFAOYSA-N |
| XLogP | 0.86 |
| TPSA | 80.58 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 201.23 |
| LogP ≤ 5 | 0.86 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide?
The IUPAC name of 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide (CID 115489725) is 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide.
What is the SMILES notation for 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide?
The canonical SMILES for 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide is [H]/N=C(\N)c1ccc(-n2ccnc2C)cn1.
What is the InChIKey of 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide?
The InChIKey is DWQZBBJCWLJCPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5/c1-7-13-4-5-15(7)8-2-3-9(10(11)12)14-6-8/h2-6H,1H3,(H3,11,12).
What are the key properties of 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide?
5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide has a molecular weight of 201.23 g/mol, XLogP of 0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide is sourced from PubChem (CID 115489725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).