About 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine
1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine (PubChem CID 106633110) has the molecular formula C11H22N2
and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine.
Molecular Properties
| Compound Name | 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine |
| PubChem CID | 106633110 |
| Molecular Formula | C11H22N2 |
| Molecular Weight | 182.31 g/mol |
| Exact Mass | 182.18 |
| IUPAC Name | 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine |
| SMILES | C1CCC(CNCC2CCC2)NC1 |
| InChI | InChI=1S/C11H22N2/c1-2-7-13-11(6-1)9-12-8-10-4-3-5-10/h10-13H,1-9H2 |
| InChIKey | GCIUXLGYSJKWKZ-UHFFFAOYSA-N |
| XLogP | 1.52 |
| TPSA | 24.06 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| 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-(piperidin-2-ylmethyl)methanamine?
The IUPAC name of 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine (CID 106633110) is 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine.
What is the SMILES notation for 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine?
The canonical SMILES for 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine is C1CCC(CNCC2CCC2)NC1.
What is the InChIKey of 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine?
The InChIKey is GCIUXLGYSJKWKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-2-7-13-11(6-1)9-12-8-10-4-3-5-10/h10-13H,1-9H2.
What are the key properties of 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine?
1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine has a molecular weight of 182.31 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine is sourced from PubChem (CID 106633110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).