About 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine
1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine (PubChem CID 107586869) has the molecular formula C14H23N3
and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine.
Molecular Properties
| Compound Name | 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine |
| PubChem CID | 107586869 |
| Molecular Formula | C14H23N3 |
| Molecular Weight | 233.36 g/mol |
| Exact Mass | 233.19 |
| IUPAC Name | 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine |
| SMILES | CCCNC1CCCN(c2cncc(C)c2)C1 |
| InChI | InChI=1S/C14H23N3/c1-3-6-16-13-5-4-7-17(11-13)14-8-12(2)9-15-10-14/h8-10,13,16H,3-7,11H2,1-2H3 |
| InChIKey | QZUFETZHOHSSQD-UHFFFAOYSA-N |
| XLogP | 2.36 |
| TPSA | 28.16 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 233.36 |
| LogP ≤ 5 | 2.36 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine?
The IUPAC name of 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine (CID 107586869) is 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine.
What is the SMILES notation for 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine?
The canonical SMILES for 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine is CCCNC1CCCN(c2cncc(C)c2)C1.
What is the InChIKey of 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine?
The InChIKey is QZUFETZHOHSSQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-6-16-13-5-4-7-17(11-13)14-8-12(2)9-15-10-14/h8-10,13,16H,3-7,11H2,1-2H3.
What are the key properties of 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine?
1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine has a molecular weight of 233.36 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-3-pyridinyl)-N-propylpiperidin-3-amine is sourced from PubChem (CID 107586869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).