About 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine
1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine (PubChem CID 83995937) has the molecular formula C16H32N2
and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine.
Molecular Properties
| Compound Name | 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine |
| PubChem CID | 83995937 |
| Molecular Formula | C16H32N2 |
| Molecular Weight | 252.45 g/mol |
| Exact Mass | 252.26 |
| IUPAC Name | 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine |
| SMILES | CC(C)CCNC1CCCN(C2CCCCC2)C1 |
| InChI | InChI=1S/C16H32N2/c1-14(2)10-11-17-15-7-6-12-18(13-15)16-8-4-3-5-9-16/h14-17H,3-13H2,1-2H3 |
| InChIKey | AZUXPBWZHNMTFF-UHFFFAOYSA-N |
| XLogP | 3.42 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 252.45 |
| LogP ≤ 5 | 3.42 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine?
The IUPAC name of 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine (CID 83995937) is 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine.
What is the SMILES notation for 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine?
The canonical SMILES for 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine is CC(C)CCNC1CCCN(C2CCCCC2)C1.
What is the InChIKey of 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine?
The InChIKey is AZUXPBWZHNMTFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-14(2)10-11-17-15-7-6-12-18(13-15)16-8-4-3-5-9-16/h14-17H,3-13H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine?
1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine has a molecular weight of 252.45 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine is sourced from PubChem (CID 83995937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).