About N-benzyl-5-ethylpyridin-2-amine
N-benzyl-5-ethylpyridin-2-amine (PubChem CID 53404811) has the molecular formula C14H16N2
and a molecular weight of 212.30 g/mol. Its IUPAC name is N-benzyl-5-ethylpyridin-2-amine.
Molecular Properties
| Compound Name | N-benzyl-5-ethylpyridin-2-amine |
| PubChem CID | 53404811 |
| Molecular Formula | C14H16N2 |
| Molecular Weight | 212.30 g/mol |
| Exact Mass | 212.13 |
| IUPAC Name | N-benzyl-5-ethylpyridin-2-amine |
| SMILES | CCc1ccc(NCc2ccccc2)nc1 |
| InChI | InChI=1S/C14H16N2/c1-2-12-8-9-14(15-10-12)16-11-13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H,15,16) |
| InChIKey | SXTZHQOLFHNMIA-UHFFFAOYSA-N |
| XLogP | 3.26 |
| TPSA | 24.92 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 212.30 |
| LogP ≤ 5 | 3.26 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-benzyl-5-ethylpyridin-2-amine?
The IUPAC name of N-benzyl-5-ethylpyridin-2-amine (CID 53404811) is N-benzyl-5-ethylpyridin-2-amine.
What is the SMILES notation for N-benzyl-5-ethylpyridin-2-amine?
The canonical SMILES for N-benzyl-5-ethylpyridin-2-amine is CCc1ccc(NCc2ccccc2)nc1.
What is the InChIKey of N-benzyl-5-ethylpyridin-2-amine?
The InChIKey is SXTZHQOLFHNMIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-2-12-8-9-14(15-10-12)16-11-13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H,15,16).
What are the key properties of N-benzyl-5-ethylpyridin-2-amine?
N-benzyl-5-ethylpyridin-2-amine has a molecular weight of 212.30 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-ethylpyridin-2-amine is sourced from PubChem (CID 53404811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).