About N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine
N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine (PubChem CID 102968384) has the molecular formula C15H30N2O
and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine.
Molecular Properties
| Compound Name | N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine |
| PubChem CID | 102968384 |
| Molecular Formula | C15H30N2O |
| Molecular Weight | 254.42 g/mol |
| Exact Mass | 254.24 |
| IUPAC Name | N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine |
| SMILES | COC1CCCN(C(C)CNC2CCCCC2)C1 |
| InChI | InChI=1S/C15H30N2O/c1-13(11-16-14-7-4-3-5-8-14)17-10-6-9-15(12-17)18-2/h13-16H,3-12H2,1-2H3 |
| InChIKey | ZJDRGQXKZARRSJ-UHFFFAOYSA-N |
| XLogP | 2.41 |
| TPSA | 24.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 254.42 |
| LogP ≤ 5 | 2.41 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine?
The IUPAC name of N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine (CID 102968384) is N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine.
What is the SMILES notation for N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine?
The canonical SMILES for N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine is COC1CCCN(C(C)CNC2CCCCC2)C1.
What is the InChIKey of N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine?
The InChIKey is ZJDRGQXKZARRSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-13(11-16-14-7-4-3-5-8-14)17-10-6-9-15(12-17)18-2/h13-16H,3-12H2,1-2H3.
What are the key properties of N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine?
N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine has a molecular weight of 254.42 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxypiperidin-1-yl)propyl]cyclohexanamine is sourced from PubChem (CID 102968384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).