About 5-amino-N-(2-chlorophenyl)furan-2-carboxamide
5-amino-N-(2-chlorophenyl)furan-2-carboxamide (PubChem CID 82344260) has the molecular formula C11H9ClN2O2
and a molecular weight of 236.66 g/mol. Its IUPAC name is 5-amino-N-(2-chlorophenyl)furan-2-carboxamide.
Molecular Properties
| Compound Name | 5-amino-N-(2-chlorophenyl)furan-2-carboxamide |
| PubChem CID | 82344260 |
| Molecular Formula | C11H9ClN2O2 |
| Molecular Weight | 236.66 g/mol |
| Exact Mass | 236.04 |
| IUPAC Name | 5-amino-N-(2-chlorophenyl)furan-2-carboxamide |
| SMILES | Nc1ccc(C(=O)Nc2ccccc2Cl)o1 |
| InChI | InChI=1S/C11H9ClN2O2/c12-7-3-1-2-4-8(7)14-11(15)9-5-6-10(13)16-9/h1-6H,13H2,(H,14,15) |
| InChIKey | MGWXSYAOAXVMEQ-UHFFFAOYSA-N |
| XLogP | 2.77 |
| TPSA | 68.26 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 236.66 |
| LogP ≤ 5 | 2.77 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 5-amino-N-(2-chlorophenyl)furan-2-carboxamide?
The IUPAC name of 5-amino-N-(2-chlorophenyl)furan-2-carboxamide (CID 82344260) is 5-amino-N-(2-chlorophenyl)furan-2-carboxamide.
What is the SMILES notation for 5-amino-N-(2-chlorophenyl)furan-2-carboxamide?
The canonical SMILES for 5-amino-N-(2-chlorophenyl)furan-2-carboxamide is Nc1ccc(C(=O)Nc2ccccc2Cl)o1.
What is the InChIKey of 5-amino-N-(2-chlorophenyl)furan-2-carboxamide?
The InChIKey is MGWXSYAOAXVMEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O2/c12-7-3-1-2-4-8(7)14-11(15)9-5-6-10(13)16-9/h1-6H,13H2,(H,14,15).
What are the key properties of 5-amino-N-(2-chlorophenyl)furan-2-carboxamide?
5-amino-N-(2-chlorophenyl)furan-2-carboxamide has a molecular weight of 236.66 g/mol, XLogP of 2.77, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-chlorophenyl)furan-2-carboxamide is sourced from PubChem (CID 82344260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).