About N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine
N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine (PubChem CID 2849472) has the molecular formula C10H22N2O
and a molecular weight of 186.29 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine.
Molecular Properties
| Compound Name | N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine |
| PubChem CID | 2849472 |
| Molecular Formula | C10H22N2O |
| Molecular Weight | 186.29 g/mol |
| Exact Mass | 186.17 |
| IUPAC Name | N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine |
| SMILES | CC(COC)NC1CCN(CC1)C |
| InChI | InChI=1S/C10H22N2O/c1-9(8-13-3)11-10-4-6-12(2)7-5-10/h9-11H,4-8H2,1-3H3 |
| InChIKey | POWQWFMHKZORAN-UHFFFAOYSA-N |
| XLogP | 0.70 |
| TPSA | 24.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 13 |
| Complexity | 133 |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 186.29 |
| LogP ≤ 5 | 0.70 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine (CID 2849472) is N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine is CC(COC)NC1CCN(CC1)C.
What is the InChIKey of N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine?
The InChIKey is POWQWFMHKZORAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(8-13-3)11-10-4-6-12(2)7-5-10/h9-11H,4-8H2,1-3H3.
What are the key properties of N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine?
N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine has a molecular weight of 186.29 g/mol, XLogP of 0.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine is sourced from PubChem (CID 2849472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).