About 6-methoxynaphthalene-2-carboximidamide
6-methoxynaphthalene-2-carboximidamide (PubChem CID 3274917) has the molecular formula C12H12N2O
and a molecular weight of 200.24 g/mol. Its IUPAC name is 6-methoxynaphthalene-2-carboximidamide.
Molecular Properties
| Compound Name | 6-methoxynaphthalene-2-carboximidamide |
| PubChem CID | 3274917 |
| Molecular Formula | C12H12N2O |
| Molecular Weight | 200.24 g/mol |
| Exact Mass | 200.09 |
| IUPAC Name | 6-methoxynaphthalene-2-carboximidamide |
| SMILES | [H]/N=C(\N)c1ccc2cc(OC)ccc2c1 |
| InChI | InChI=1S/C12H12N2O/c1-15-11-5-4-8-6-10(12(13)14)3-2-9(8)7-11/h2-7H,1H3,(H3,13,14) |
| InChIKey | AFACJVQMKAPFID-UHFFFAOYSA-N |
| XLogP | 2.13 |
| TPSA | 59.10 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 200.24 |
| LogP ≤ 5 | 2.13 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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 6-methoxynaphthalene-2-carboximidamide?
The IUPAC name of 6-methoxynaphthalene-2-carboximidamide (CID 3274917) is 6-methoxynaphthalene-2-carboximidamide.
What is the SMILES notation for 6-methoxynaphthalene-2-carboximidamide?
The canonical SMILES for 6-methoxynaphthalene-2-carboximidamide is [H]/N=C(\N)c1ccc2cc(OC)ccc2c1.
What is the InChIKey of 6-methoxynaphthalene-2-carboximidamide?
The InChIKey is AFACJVQMKAPFID-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-15-11-5-4-8-6-10(12(13)14)3-2-9(8)7-11/h2-7H,1H3,(H3,13,14).
What are the key properties of 6-methoxynaphthalene-2-carboximidamide?
6-methoxynaphthalene-2-carboximidamide has a molecular weight of 200.24 g/mol, XLogP of 2.13, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxynaphthalene-2-carboximidamide is sourced from PubChem (CID 3274917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).