About N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine
N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine (PubChem CID 1090542) has the molecular formula C16H15NO
and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine.
Molecular Properties
| Compound Name | N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine |
| PubChem CID | 1090542 |
| Molecular Formula | C16H15NO |
| Molecular Weight | 237.30 g/mol |
| Exact Mass | 237.12 |
| IUPAC Name | N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine |
| SMILES | c1coc(CNCc2cccc3ccccc23)c1 |
| InChI | InChI=1S/C16H15NO/c1-2-9-16-13(5-1)6-3-7-14(16)11-17-12-15-8-4-10-18-15/h1-10,17H,11-12H2 |
| InChIKey | FLNWBNLZGZPQSG-UHFFFAOYSA-N |
| XLogP | 3.72 |
| TPSA | 25.17 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 237.30 |
| LogP ≤ 5 | 3.72 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine?
The IUPAC name of N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine (CID 1090542) is N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine.
What is the SMILES notation for N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine?
The canonical SMILES for N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine is c1coc(CNCc2cccc3ccccc23)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine?
The InChIKey is FLNWBNLZGZPQSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c1-2-9-16-13(5-1)6-3-7-14(16)11-17-12-15-8-4-10-18-15/h1-10,17H,11-12H2.
What are the key properties of N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine?
N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine has a molecular weight of 237.30 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine is sourced from PubChem (CID 1090542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).