About 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine
5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine (PubChem CID 114046391) has the molecular formula C12H18ClN3O
and a molecular weight of 255.75 g/mol. Its IUPAC name is 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine.
Molecular Properties
| Compound Name | 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine |
| PubChem CID | 114046391 |
| Molecular Formula | C12H18ClN3O |
| Molecular Weight | 255.75 g/mol |
| Exact Mass | 255.11 |
| IUPAC Name | 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine |
| SMILES | Nc1cnc(OCCN2CCCCC2)c(Cl)c1 |
| InChI | InChI=1S/C12H18ClN3O/c13-11-8-10(14)9-15-12(11)17-7-6-16-4-2-1-3-5-16/h8-9H,1-7,14H2 |
| InChIKey | SHNZZGLTSIIFFI-UHFFFAOYSA-N |
| XLogP | 2.18 |
| TPSA | 51.38 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 255.75 |
| LogP ≤ 5 | 2.18 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine?
The IUPAC name of 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine (CID 114046391) is 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine.
What is the SMILES notation for 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine?
The canonical SMILES for 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine is Nc1cnc(OCCN2CCCCC2)c(Cl)c1.
What is the InChIKey of 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine?
The InChIKey is SHNZZGLTSIIFFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN3O/c13-11-8-10(14)9-15-12(11)17-7-6-16-4-2-1-3-5-16/h8-9H,1-7,14H2.
What are the key properties of 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine?
5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine has a molecular weight of 255.75 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(2-piperidin-1-ylethoxy)pyridin-3-amine is sourced from PubChem (CID 114046391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).