About 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide
2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide (PubChem CID 24702895) has the molecular formula C14H15N3O2
and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide.
Molecular Properties
| Compound Name | 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide |
| PubChem CID | 24702895 |
| Molecular Formula | C14H15N3O2 |
| Molecular Weight | 257.29 g/mol |
| Exact Mass | 257.12 |
| IUPAC Name | 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide |
| SMILES | [H]/N=C(\N)c1ccnc(Oc2ccc(C)cc2OC)c1 |
| InChI | InChI=1S/C14H15N3O2/c1-9-3-4-11(12(7-9)18-2)19-13-8-10(14(15)16)5-6-17-13/h3-8H,1-2H3,(H3,15,16) |
| InChIKey | GFGWJDFTKLVQEX-UHFFFAOYSA-N |
| XLogP | 2.47 |
| TPSA | 81.22 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 257.29 |
| LogP ≤ 5 | 2.47 |
| 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 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide?
The IUPAC name of 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide (CID 24702895) is 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide.
What is the SMILES notation for 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide?
The canonical SMILES for 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide is [H]/N=C(\N)c1ccnc(Oc2ccc(C)cc2OC)c1.
What is the InChIKey of 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide?
The InChIKey is GFGWJDFTKLVQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-9-3-4-11(12(7-9)18-2)19-13-8-10(14(15)16)5-6-17-13/h3-8H,1-2H3,(H3,15,16).
What are the key properties of 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide?
2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide has a molecular weight of 257.29 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-4-methylphenoxy)pyridine-4-carboximidamide is sourced from PubChem (CID 24702895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).