About 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine (PubChem CID 83997328) has the molecular formula C15H28N2
and a molecular weight of 236.40 g/mol. Its IUPAC name is 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine.
Molecular Properties
| Compound Name | 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine |
| PubChem CID | 83997328 |
| Molecular Formula | C15H28N2 |
| Molecular Weight | 236.40 g/mol |
| Exact Mass | 236.23 |
| IUPAC Name | 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine |
| SMILES | CC1CC(NCC2CCC2)CN(C2CCC2)C1 |
| InChI | InChI=1S/C15H28N2/c1-12-8-14(16-9-13-4-2-5-13)11-17(10-12)15-6-3-7-15/h12-16H,2-11H2,1H3 |
| InChIKey | DKIVWEGSHQSMGY-UHFFFAOYSA-N |
| XLogP | 2.64 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 236.40 |
| LogP ≤ 5 | 2.64 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Analyze 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine?
The IUPAC name of 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine (CID 83997328) is 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine.
What is the SMILES notation for 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine?
The canonical SMILES for 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine is CC1CC(NCC2CCC2)CN(C2CCC2)C1.
What is the InChIKey of 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine?
The InChIKey is DKIVWEGSHQSMGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-12-8-14(16-9-13-4-2-5-13)11-17(10-12)15-6-3-7-15/h12-16H,2-11H2,1H3.
What are the key properties of 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine?
1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine has a molecular weight of 236.40 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine is sourced from PubChem (CID 83997328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).