About N-(2-fluoro-5-methylphenyl)-4-methylbenzamide
N-(2-fluoro-5-methylphenyl)-4-methylbenzamide (PubChem CID 7718843) has the molecular formula C15H14FNO
and a molecular weight of 243.28 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-4-methylbenzamide.
Molecular Properties
| Compound Name | N-(2-fluoro-5-methylphenyl)-4-methylbenzamide |
| PubChem CID | 7718843 |
| Molecular Formula | C15H14FNO |
| Molecular Weight | 243.28 g/mol |
| Exact Mass | 243.11 |
| IUPAC Name | N-(2-fluoro-5-methylphenyl)-4-methylbenzamide |
| SMILES | Cc1ccc(C(=O)Nc2cc(C)ccc2F)cc1 |
| InChI | InChI=1S/C15H14FNO/c1-10-3-6-12(7-4-10)15(18)17-14-9-11(2)5-8-13(14)16/h3-9H,1-2H3,(H,17,18) |
| InChIKey | ZXZZAANBYJLZKJ-UHFFFAOYSA-N |
| XLogP | 3.69 |
| TPSA | 29.10 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 243.28 |
| LogP ≤ 5 | 3.69 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-4-methylbenzamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-4-methylbenzamide (CID 7718843) is N-(2-fluoro-5-methylphenyl)-4-methylbenzamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-4-methylbenzamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-4-methylbenzamide is Cc1ccc(C(=O)Nc2cc(C)ccc2F)cc1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-4-methylbenzamide?
The InChIKey is ZXZZAANBYJLZKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO/c1-10-3-6-12(7-4-10)15(18)17-14-9-11(2)5-8-13(14)16/h3-9H,1-2H3,(H,17,18).
What are the key properties of N-(2-fluoro-5-methylphenyl)-4-methylbenzamide?
N-(2-fluoro-5-methylphenyl)-4-methylbenzamide has a molecular weight of 243.28 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-4-methylbenzamide is sourced from PubChem (CID 7718843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).