About N-methyl-2-naphthalen-2-ylpropan-1-amine
N-methyl-2-naphthalen-2-ylpropan-1-amine (PubChem CID 19847434) has the molecular formula C14H17N
and a molecular weight of 199.30 g/mol. Its IUPAC name is N-methyl-2-naphthalen-2-ylpropan-1-amine.
Molecular Properties
| Compound Name | N-methyl-2-naphthalen-2-ylpropan-1-amine |
| PubChem CID | 19847434 |
| Molecular Formula | C14H17N |
| Molecular Weight | 199.30 g/mol |
| Exact Mass | 199.14 |
| IUPAC Name | N-methyl-2-naphthalen-2-ylpropan-1-amine |
| SMILES | CNCC(C)c1ccc2ccccc2c1 |
| InChI | InChI=1S/C14H17N/c1-11(10-15-2)13-8-7-12-5-3-4-6-14(12)9-13/h3-9,11,15H,10H2,1-2H3 |
| InChIKey | ZXTRAIPGWLZADB-UHFFFAOYSA-N |
| XLogP | 3.16 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.30 |
| LogP ≤ 5 | 3.16 |
| 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-2-naphthalen-2-ylpropan-1-amine?
The IUPAC name of N-methyl-2-naphthalen-2-ylpropan-1-amine (CID 19847434) is N-methyl-2-naphthalen-2-ylpropan-1-amine.
What is the SMILES notation for N-methyl-2-naphthalen-2-ylpropan-1-amine?
The canonical SMILES for N-methyl-2-naphthalen-2-ylpropan-1-amine is CNCC(C)c1ccc2ccccc2c1.
What is the InChIKey of N-methyl-2-naphthalen-2-ylpropan-1-amine?
The InChIKey is ZXTRAIPGWLZADB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N/c1-11(10-15-2)13-8-7-12-5-3-4-6-14(12)9-13/h3-9,11,15H,10H2,1-2H3.
What are the key properties of N-methyl-2-naphthalen-2-ylpropan-1-amine?
N-methyl-2-naphthalen-2-ylpropan-1-amine has a molecular weight of 199.30 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-naphthalen-2-ylpropan-1-amine is sourced from PubChem (CID 19847434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).