About 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide
2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide (PubChem CID 166694179) has the molecular formula C17H14F2N4O2
and a molecular weight of 344.32 g/mol. Its IUPAC name is 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide.
Molecular Properties
| Compound Name | 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide |
| PubChem CID | 166694179 |
| Molecular Formula | C17H14F2N4O2 |
| Molecular Weight | 344.32 g/mol |
| Exact Mass | 344.11 |
| IUPAC Name | 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide |
| SMILES | O=CN(CC(=O)NCc1cn2ccccc2n1)c1ccc(F)cc1F |
| InChI | InChI=1S/C17H14F2N4O2/c18-12-4-5-15(14(19)7-12)23(11-24)10-17(25)20-8-13-9-22-6-2-1-3-16(22)21-13/h1-7,9,11H,8,10H2,(H,20,25) |
| InChIKey | KPLBFLHLQYVXLX-UHFFFAOYSA-N |
| XLogP | 1.89 |
| TPSA | 66.71 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 344.32 |
| LogP ≤ 5 | 1.89 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aldehyde', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide (CID 166694179) is 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide is O=CN(CC(=O)NCc1cn2ccccc2n1)c1ccc(F)cc1F.
What is the InChIKey of 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide?
The InChIKey is KPLBFLHLQYVXLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F2N4O2/c18-12-4-5-15(14(19)7-12)23(11-24)10-17(25)20-8-13-9-22-6-2-1-3-16(22)21-13/h1-7,9,11H,8,10H2,(H,20,25).
What are the key properties of 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide?
2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide has a molecular weight of 344.32 g/mol, XLogP of 1.89, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluoro-N-formylanilino)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 166694179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).