About N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide
N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide (PubChem CID 67762492) has the molecular formula C18H34N4O
and a molecular weight of 322.50 g/mol. Its IUPAC name is N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide.
Molecular Properties
| Compound Name | N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide |
| PubChem CID | 67762492 |
| Molecular Formula | C18H34N4O |
| Molecular Weight | 322.50 g/mol |
| Exact Mass | 322.27 |
| IUPAC Name | N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide |
| SMILES | O=C(CCN1CCN(C2CCNCC2)CC1)NC1CCCCC1 |
| InChI | InChI=1S/C18H34N4O/c23-18(20-16-4-2-1-3-5-16)8-11-21-12-14-22(15-13-21)17-6-9-19-10-7-17/h16-17,19H,1-15H2,(H,20,23) |
| InChIKey | YMFJWLQXWNFJKC-UHFFFAOYSA-N |
| XLogP | 1.20 |
| TPSA | 47.61 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 322.50 |
| LogP ≤ 5 | 1.20 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide?
The IUPAC name of N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide (CID 67762492) is N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide.
What is the SMILES notation for N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide?
The canonical SMILES for N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide is O=C(CCN1CCN(C2CCNCC2)CC1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide?
The InChIKey is YMFJWLQXWNFJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N4O/c23-18(20-16-4-2-1-3-5-16)8-11-21-12-14-22(15-13-21)17-6-9-19-10-7-17/h16-17,19H,1-15H2,(H,20,23).
What are the key properties of N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide?
N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide has a molecular weight of 322.50 g/mol, XLogP of 1.20, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide is sourced from PubChem (CID 67762492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).