About 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine
6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine (PubChem CID 70974280) has the molecular formula C13H15N3
and a molecular weight of 213.28 g/mol. Its IUPAC name is 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine.
Molecular Properties
| Compound Name | 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine |
| PubChem CID | 70974280 |
| Molecular Formula | C13H15N3 |
| Molecular Weight | 213.28 g/mol |
| Exact Mass | 213.13 |
| IUPAC Name | 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine |
| SMILES | CC(C)c1cccc(Nc2ccccn2)n1 |
| InChI | InChI=1S/C13H15N3/c1-10(2)11-6-5-8-13(15-11)16-12-7-3-4-9-14-12/h3-10H,1-2H3,(H,14,15,16) |
| InChIKey | IJDROLZMXJPTJL-UHFFFAOYSA-N |
| XLogP | 3.34 |
| TPSA | 37.81 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 213.28 |
| LogP ≤ 5 | 3.34 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine?
The IUPAC name of 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine (CID 70974280) is 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine.
What is the SMILES notation for 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine?
The canonical SMILES for 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine is CC(C)c1cccc(Nc2ccccn2)n1.
What is the InChIKey of 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine?
The InChIKey is IJDROLZMXJPTJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-10(2)11-6-5-8-13(15-11)16-12-7-3-4-9-14-12/h3-10H,1-2H3,(H,14,15,16).
What are the key properties of 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine?
6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine has a molecular weight of 213.28 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-N-pyridin-2-ylpyridin-2-amine is sourced from PubChem (CID 70974280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).