About 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine
1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine (PubChem CID 116951232) has the molecular formula C11H22N2
and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine.
Molecular Properties
| Compound Name | 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine |
| PubChem CID | 116951232 |
| Molecular Formula | C11H22N2 |
| Molecular Weight | 182.31 g/mol |
| Exact Mass | 182.18 |
| IUPAC Name | 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine |
| SMILES | CNC(C1CCC1)C1CCCCN1 |
| InChI | InChI=1S/C11H22N2/c1-12-11(9-5-4-6-9)10-7-2-3-8-13-10/h9-13H,2-8H2,1H3 |
| InChIKey | WESAGGZKESXFKA-UHFFFAOYSA-N |
| XLogP | 1.52 |
| TPSA | 24.06 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 182.31 |
| LogP ≤ 5 | 1.52 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine?
The IUPAC name of 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine (CID 116951232) is 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine.
What is the SMILES notation for 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine?
The canonical SMILES for 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine is CNC(C1CCC1)C1CCCCN1.
What is the InChIKey of 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine?
The InChIKey is WESAGGZKESXFKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-12-11(9-5-4-6-9)10-7-2-3-8-13-10/h9-13H,2-8H2,1H3.
What are the key properties of 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine?
1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine has a molecular weight of 182.31 g/mol, XLogP of 1.52, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine is sourced from PubChem (CID 116951232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).