About N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine
N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine (PubChem CID 105408323) has the molecular formula C19H19N
and a molecular weight of 261.37 g/mol. Its IUPAC name is N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine.
Molecular Properties
| Compound Name | N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine |
| PubChem CID | 105408323 |
| Molecular Formula | C19H19N |
| Molecular Weight | 261.37 g/mol |
| Exact Mass | 261.15 |
| IUPAC Name | N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine |
| SMILES | CNCc1ccc(C)c(-c2cccc3ccccc23)c1 |
| InChI | InChI=1S/C19H19N/c1-14-10-11-15(13-20-2)12-19(14)18-9-5-7-16-6-3-4-8-17(16)18/h3-12,20H,13H2,1-2H3 |
| InChIKey | GTMBPZDEJXZURB-UHFFFAOYSA-N |
| XLogP | 4.53 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 261.37 |
| LogP ≤ 5 | 4.53 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine?
The IUPAC name of N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine (CID 105408323) is N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine.
What is the SMILES notation for N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine?
The canonical SMILES for N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine is CNCc1ccc(C)c(-c2cccc3ccccc23)c1.
What is the InChIKey of N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine?
The InChIKey is GTMBPZDEJXZURB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N/c1-14-10-11-15(13-20-2)12-19(14)18-9-5-7-16-6-3-4-8-17(16)18/h3-12,20H,13H2,1-2H3.
What are the key properties of N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine?
N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine has a molecular weight of 261.37 g/mol, XLogP of 4.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine is sourced from PubChem (CID 105408323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).