About 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide
4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide (PubChem CID 114002229) has the molecular formula C10H10FN3O3
and a molecular weight of 239.21 g/mol. Its IUPAC name is 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide.
Molecular Properties
| Compound Name | 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide |
| PubChem CID | 114002229 |
| Molecular Formula | C10H10FN3O3 |
| Molecular Weight | 239.21 g/mol |
| Exact Mass | 239.07 |
| IUPAC Name | 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide |
| SMILES | Nc1ccc(C(=O)N[C@@H]2CONC2=O)c(F)c1 |
| InChI | InChI=1S/C10H10FN3O3/c11-7-3-5(12)1-2-6(7)9(15)13-8-4-17-14-10(8)16/h1-3,8H,4,12H2,(H,13,15)(H,14,16)/t8-/m1/s1 |
| InChIKey | JZGZDQZFGLUHSO-MRVPVSSYSA-N |
| XLogP | -0.43 |
| TPSA | 93.45 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 239.21 |
| LogP ≤ 5 | -0.43 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aniline', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide?
The IUPAC name of 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide (CID 114002229) is 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide.
What is the SMILES notation for 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide?
The canonical SMILES for 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide is Nc1ccc(C(=O)N[C@@H]2CONC2=O)c(F)c1.
What is the InChIKey of 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide?
The InChIKey is JZGZDQZFGLUHSO-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H10FN3O3/c11-7-3-5(12)1-2-6(7)9(15)13-8-4-17-14-10(8)16/h1-3,8H,4,12H2,(H,13,15)(H,14,16)/t8-/m1/s1.
What are the key properties of 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide?
4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide has a molecular weight of 239.21 g/mol, XLogP of -0.43, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-fluoro-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]benzamide is sourced from PubChem (CID 114002229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).