About cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone
cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone (PubChem CID 114498355) has the molecular formula C14H26N2O
and a molecular weight of 238.37 g/mol. Its IUPAC name is cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone.
Molecular Properties
| Compound Name | cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone |
| PubChem CID | 114498355 |
| Molecular Formula | C14H26N2O |
| Molecular Weight | 238.37 g/mol |
| Exact Mass | 238.20 |
| IUPAC Name | cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone |
| SMILES | CNC1CCN(C(=O)C2CCCCC2)CC1C |
| InChI | InChI=1S/C14H26N2O/c1-11-10-16(9-8-13(11)15-2)14(17)12-6-4-3-5-7-12/h11-13,15H,3-10H2,1-2H3 |
| InChIKey | FAPMTLRUZAPQQF-UHFFFAOYSA-N |
| XLogP | 2.02 |
| TPSA | 32.34 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 238.37 |
| LogP ≤ 5 | 2.02 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone?
The IUPAC name of cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone (CID 114498355) is cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone.
What is the SMILES notation for cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone?
The canonical SMILES for cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone is CNC1CCN(C(=O)C2CCCCC2)CC1C.
What is the InChIKey of cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone?
The InChIKey is FAPMTLRUZAPQQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-11-10-16(9-8-13(11)15-2)14(17)12-6-4-3-5-7-12/h11-13,15H,3-10H2,1-2H3.
What are the key properties of cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone?
cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone has a molecular weight of 238.37 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[3-methyl-4-(methylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 114498355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).