About 6-chloro-2-piperidin-4-ylpyridin-3-amine
6-chloro-2-piperidin-4-ylpyridin-3-amine (PubChem CID 169253686) has the molecular formula C10H14ClN3
and a molecular weight of 211.70 g/mol. Its IUPAC name is 6-chloro-2-piperidin-4-ylpyridin-3-amine.
Molecular Properties
| Compound Name | 6-chloro-2-piperidin-4-ylpyridin-3-amine |
| PubChem CID | 169253686 |
| Molecular Formula | C10H14ClN3 |
| Molecular Weight | 211.70 g/mol |
| Exact Mass | 211.09 |
| IUPAC Name | 6-chloro-2-piperidin-4-ylpyridin-3-amine |
| SMILES | Nc1ccc(Cl)nc1C1CCNCC1 |
| InChI | InChI=1S/C10H14ClN3/c11-9-2-1-8(12)10(14-9)7-3-5-13-6-4-7/h1-2,7,13H,3-6,12H2 |
| InChIKey | QALVDDHVLJQDHC-UHFFFAOYSA-N |
| XLogP | 1.78 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 211.70 |
| LogP ≤ 5 | 1.78 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 6-chloro-2-piperidin-4-ylpyridin-3-amine?
The IUPAC name of 6-chloro-2-piperidin-4-ylpyridin-3-amine (CID 169253686) is 6-chloro-2-piperidin-4-ylpyridin-3-amine.
What is the SMILES notation for 6-chloro-2-piperidin-4-ylpyridin-3-amine?
The canonical SMILES for 6-chloro-2-piperidin-4-ylpyridin-3-amine is Nc1ccc(Cl)nc1C1CCNCC1.
What is the InChIKey of 6-chloro-2-piperidin-4-ylpyridin-3-amine?
The InChIKey is QALVDDHVLJQDHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3/c11-9-2-1-8(12)10(14-9)7-3-5-13-6-4-7/h1-2,7,13H,3-6,12H2.
What are the key properties of 6-chloro-2-piperidin-4-ylpyridin-3-amine?
6-chloro-2-piperidin-4-ylpyridin-3-amine has a molecular weight of 211.70 g/mol, XLogP of 1.78, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-piperidin-4-ylpyridin-3-amine is sourced from PubChem (CID 169253686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).