About 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide
5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide (PubChem CID 114408602) has the molecular formula C9H13N3O3
and a molecular weight of 211.22 g/mol. Its IUPAC name is 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide.
Molecular Properties
| Compound Name | 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide |
| PubChem CID | 114408602 |
| Molecular Formula | C9H13N3O3 |
| Molecular Weight | 211.22 g/mol |
| Exact Mass | 211.10 |
| IUPAC Name | 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide |
| SMILES | COCCOc1nc(C(N)=O)ccc1N |
| InChI | InChI=1S/C9H13N3O3/c1-14-4-5-15-9-6(10)2-3-7(12-9)8(11)13/h2-3H,4-5,10H2,1H3,(H2,11,13) |
| InChIKey | ZBHKFBDDJJZNSN-UHFFFAOYSA-N |
| XLogP | -0.21 |
| TPSA | 100.46 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 211.22 |
| LogP ≤ 5 | -0.21 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide?
The IUPAC name of 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide (CID 114408602) is 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide is COCCOc1nc(C(N)=O)ccc1N.
What is the InChIKey of 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide?
The InChIKey is ZBHKFBDDJJZNSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3/c1-14-4-5-15-9-6(10)2-3-7(12-9)8(11)13/h2-3H,4-5,10H2,1H3,(H2,11,13).
What are the key properties of 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide?
5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide has a molecular weight of 211.22 g/mol, XLogP of -0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide is sourced from PubChem (CID 114408602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).