About N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine
N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine (PubChem CID 83999692) has the molecular formula C17H26N2
and a molecular weight of 258.41 g/mol. Its IUPAC name is N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine.
Molecular Properties
| Compound Name | N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine |
| PubChem CID | 83999692 |
| Molecular Formula | C17H26N2 |
| Molecular Weight | 258.41 g/mol |
| Exact Mass | 258.21 |
| IUPAC Name | N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine |
| SMILES | CN1CC(NC2CCCC2)CC(c2ccccc2)C1 |
| InChI | InChI=1S/C17H26N2/c1-19-12-15(14-7-3-2-4-8-14)11-17(13-19)18-16-9-5-6-10-16/h2-4,7-8,15-18H,5-6,9-13H2,1H3 |
| InChIKey | TVXZZDGZGMMKBD-UHFFFAOYSA-N |
| XLogP | 3.01 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.41 |
| LogP ≤ 5 | 3.01 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine?
The IUPAC name of N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine (CID 83999692) is N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine.
What is the SMILES notation for N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine?
The canonical SMILES for N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine is CN1CC(NC2CCCC2)CC(c2ccccc2)C1.
What is the InChIKey of N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine?
The InChIKey is TVXZZDGZGMMKBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-19-12-15(14-7-3-2-4-8-14)11-17(13-19)18-16-9-5-6-10-16/h2-4,7-8,15-18H,5-6,9-13H2,1H3.
What are the key properties of N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine?
N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine has a molecular weight of 258.41 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine is sourced from PubChem (CID 83999692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).