About 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide
5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide (PubChem CID 103604079) has the molecular formula C14H13Cl2NO3
and a molecular weight of 314.17 g/mol. Its IUPAC name is 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide.
Molecular Properties
| Compound Name | 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide |
| PubChem CID | 103604079 |
| Molecular Formula | C14H13Cl2NO3 |
| Molecular Weight | 314.17 g/mol |
| Exact Mass | 313.03 |
| IUPAC Name | 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide |
| SMILES | CN(CCOc1ccccc1Cl)C(=O)c1ccc(Cl)o1 |
| InChI | InChI=1S/C14H13Cl2NO3/c1-17(14(18)12-6-7-13(16)20-12)8-9-19-11-5-3-2-4-10(11)15/h2-7H,8-9H2,1H3 |
| InChIKey | QJQOXCWHMMAIOB-UHFFFAOYSA-N |
| XLogP | 3.74 |
| TPSA | 42.68 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 314.17 |
| LogP ≤ 5 | 3.74 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide?
The IUPAC name of 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide (CID 103604079) is 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide?
The canonical SMILES for 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide is CN(CCOc1ccccc1Cl)C(=O)c1ccc(Cl)o1.
What is the InChIKey of 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide?
The InChIKey is QJQOXCWHMMAIOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO3/c1-17(14(18)12-6-7-13(16)20-12)8-9-19-11-5-3-2-4-10(11)15/h2-7H,8-9H2,1H3.
What are the key properties of 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide?
5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide has a molecular weight of 314.17 g/mol, XLogP of 3.74, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(2-chlorophenoxy)ethyl]-N-methylfuran-2-carboxamide is sourced from PubChem (CID 103604079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).