About 2-chloro-4-pyridin-2-ylpyridin-3-amine
2-chloro-4-pyridin-2-ylpyridin-3-amine (PubChem CID 82396148) has the molecular formula C10H8ClN3
and a molecular weight of 205.65 g/mol. Its IUPAC name is 2-chloro-4-pyridin-2-ylpyridin-3-amine.
Molecular Properties
| Compound Name | 2-chloro-4-pyridin-2-ylpyridin-3-amine |
| PubChem CID | 82396148 |
| Molecular Formula | C10H8ClN3 |
| Molecular Weight | 205.65 g/mol |
| Exact Mass | 205.04 |
| IUPAC Name | 2-chloro-4-pyridin-2-ylpyridin-3-amine |
| SMILES | Nc1c(-c2ccccn2)ccnc1Cl |
| InChI | InChI=1S/C10H8ClN3/c11-10-9(12)7(4-6-14-10)8-3-1-2-5-13-8/h1-6H,12H2 |
| InChIKey | LCVZATMTGCSGDU-UHFFFAOYSA-N |
| XLogP | 2.38 |
| TPSA | 51.80 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 205.65 |
| LogP ≤ 5 | 2.38 |
| H-Bond Donors ≤ 5 | 1 |
| 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 2-chloro-4-pyridin-2-ylpyridin-3-amine?
The IUPAC name of 2-chloro-4-pyridin-2-ylpyridin-3-amine (CID 82396148) is 2-chloro-4-pyridin-2-ylpyridin-3-amine.
What is the SMILES notation for 2-chloro-4-pyridin-2-ylpyridin-3-amine?
The canonical SMILES for 2-chloro-4-pyridin-2-ylpyridin-3-amine is Nc1c(-c2ccccn2)ccnc1Cl.
What is the InChIKey of 2-chloro-4-pyridin-2-ylpyridin-3-amine?
The InChIKey is LCVZATMTGCSGDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3/c11-10-9(12)7(4-6-14-10)8-3-1-2-5-13-8/h1-6H,12H2.
What are the key properties of 2-chloro-4-pyridin-2-ylpyridin-3-amine?
2-chloro-4-pyridin-2-ylpyridin-3-amine has a molecular weight of 205.65 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-pyridin-2-ylpyridin-3-amine is sourced from PubChem (CID 82396148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).