About 2-pyridin-3-ylpiperidin-1-amine
2-pyridin-3-ylpiperidin-1-amine (PubChem CID 5026347) has the molecular formula C10H15N3
and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-pyridin-3-ylpiperidin-1-amine.
Molecular Properties
| Compound Name | 2-pyridin-3-ylpiperidin-1-amine |
| PubChem CID | 5026347 |
| Molecular Formula | C10H15N3 |
| Molecular Weight | 177.25 g/mol |
| Exact Mass | 177.13 |
| IUPAC Name | 2-pyridin-3-ylpiperidin-1-amine |
| SMILES | NN1CCCCC1c1cccnc1 |
| InChI | InChI=1S/C10H15N3/c11-13-7-2-1-5-10(13)9-4-3-6-12-8-9/h3-4,6,8,10H,1-2,5,7,11H2 |
| InChIKey | RBKLKVOOTGOALW-UHFFFAOYSA-N |
| XLogP | 1.48 |
| TPSA | 42.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 177.25 |
| LogP ≤ 5 | 1.48 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'} |
|---|
Analyze 2-pyridin-3-ylpiperidin-1-amine with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 2-pyridin-3-ylpiperidin-1-amine?
The IUPAC name of 2-pyridin-3-ylpiperidin-1-amine (CID 5026347) is 2-pyridin-3-ylpiperidin-1-amine.
What is the SMILES notation for 2-pyridin-3-ylpiperidin-1-amine?
The canonical SMILES for 2-pyridin-3-ylpiperidin-1-amine is NN1CCCCC1c1cccnc1.
What is the InChIKey of 2-pyridin-3-ylpiperidin-1-amine?
The InChIKey is RBKLKVOOTGOALW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c11-13-7-2-1-5-10(13)9-4-3-6-12-8-9/h3-4,6,8,10H,1-2,5,7,11H2.
What are the key properties of 2-pyridin-3-ylpiperidin-1-amine?
2-pyridin-3-ylpiperidin-1-amine has a molecular weight of 177.25 g/mol, XLogP of 1.48, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-ylpiperidin-1-amine is sourced from PubChem (CID 5026347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).