About 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide
4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide (PubChem CID 42601202) has the molecular formula C24H26ClN3O4S
and a molecular weight of 488.01 g/mol. Its IUPAC name is 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide.
Molecular Properties
| Compound Name | 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide |
| PubChem CID | 42601202 |
| Molecular Formula | C24H26ClN3O4S |
| Molecular Weight | 488.01 g/mol |
| Exact Mass | 487.13 |
| IUPAC Name | 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide |
| SMILES | O=C(NCC(c1ccco1)N1CCCCC1)c1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1 |
| InChI | InChI=1S/C24H26ClN3O4S/c25-20-7-2-3-8-21(20)27-33(30,31)19-12-10-18(11-13-19)24(29)26-17-22(23-9-6-16-32-23)28-14-4-1-5-15-28/h2-3,6-13,16,22,27H,1,4-5,14-15,17H2,(H,26,29) |
| InChIKey | DMDCVLRTPMANDI-UHFFFAOYSA-N |
| XLogP | 4.69 |
| TPSA | 91.65 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 33 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 488.01 |
| LogP ≤ 5 | 4.69 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide?
The IUPAC name of 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide (CID 42601202) is 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide.
What is the SMILES notation for 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide?
The canonical SMILES for 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide is O=C(NCC(c1ccco1)N1CCCCC1)c1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1.
What is the InChIKey of 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide?
The InChIKey is DMDCVLRTPMANDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26ClN3O4S/c25-20-7-2-3-8-21(20)27-33(30,31)19-12-10-18(11-13-19)24(29)26-17-22(23-9-6-16-32-23)28-14-4-1-5-15-28/h2-3,6-13,16,22,27H,1,4-5,14-15,17H2,(H,26,29).
What are the key properties of 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide?
4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide has a molecular weight of 488.01 g/mol, XLogP of 4.69, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-chlorophenyl)sulfamoyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide is sourced from PubChem (CID 42601202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).