About N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine
N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine (PubChem CID 114221239) has the molecular formula C14H28N2O
and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine.
Molecular Properties
| Compound Name | N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine |
| PubChem CID | 114221239 |
| Molecular Formula | C14H28N2O |
| Molecular Weight | 240.39 g/mol |
| Exact Mass | 240.22 |
| IUPAC Name | N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine |
| SMILES | COC1CCN(CCNC2CCCC2)C(C)C1 |
| InChI | InChI=1S/C14H28N2O/c1-12-11-14(17-2)7-9-16(12)10-8-15-13-5-3-4-6-13/h12-15H,3-11H2,1-2H3 |
| InChIKey | KWMPIYFVQCFVPS-UHFFFAOYSA-N |
| XLogP | 2.02 |
| TPSA | 24.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 240.39 |
| LogP ≤ 5 | 2.02 |
| 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-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine?
The IUPAC name of N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine (CID 114221239) is N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine.
What is the SMILES notation for N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine?
The canonical SMILES for N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine is COC1CCN(CCNC2CCCC2)C(C)C1.
What is the InChIKey of N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine?
The InChIKey is KWMPIYFVQCFVPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12-11-14(17-2)7-9-16(12)10-8-15-13-5-3-4-6-13/h12-15H,3-11H2,1-2H3.
What are the key properties of N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine?
N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine has a molecular weight of 240.39 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxy-2-methylpiperidin-1-yl)ethyl]cyclopentanamine is sourced from PubChem (CID 114221239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).