About 2-(ethylamino)-N-methyl-3-phenylbenzamide
2-(ethylamino)-N-methyl-3-phenylbenzamide (PubChem CID 68748866) has the molecular formula C16H18N2O
and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-(ethylamino)-N-methyl-3-phenylbenzamide.
Molecular Properties
| Compound Name | 2-(ethylamino)-N-methyl-3-phenylbenzamide |
| PubChem CID | 68748866 |
| Molecular Formula | C16H18N2O |
| Molecular Weight | 254.33 g/mol |
| Exact Mass | 254.14 |
| IUPAC Name | 2-(ethylamino)-N-methyl-3-phenylbenzamide |
| SMILES | CCNc1c(C(=O)NC)cccc1-c1ccccc1 |
| InChI | InChI=1S/C16H18N2O/c1-3-18-15-13(12-8-5-4-6-9-12)10-7-11-14(15)16(19)17-2/h4-11,18H,3H2,1-2H3,(H,17,19) |
| InChIKey | NSTCIFUSKVQTKY-UHFFFAOYSA-N |
| XLogP | 3.14 |
| TPSA | 41.13 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 254.33 |
| LogP ≤ 5 | 3.14 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(ethylamino)-N-methyl-3-phenylbenzamide?
The IUPAC name of 2-(ethylamino)-N-methyl-3-phenylbenzamide (CID 68748866) is 2-(ethylamino)-N-methyl-3-phenylbenzamide.
What is the SMILES notation for 2-(ethylamino)-N-methyl-3-phenylbenzamide?
The canonical SMILES for 2-(ethylamino)-N-methyl-3-phenylbenzamide is CCNc1c(C(=O)NC)cccc1-c1ccccc1.
What is the InChIKey of 2-(ethylamino)-N-methyl-3-phenylbenzamide?
The InChIKey is NSTCIFUSKVQTKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-3-18-15-13(12-8-5-4-6-9-12)10-7-11-14(15)16(19)17-2/h4-11,18H,3H2,1-2H3,(H,17,19).
What are the key properties of 2-(ethylamino)-N-methyl-3-phenylbenzamide?
2-(ethylamino)-N-methyl-3-phenylbenzamide has a molecular weight of 254.33 g/mol, XLogP of 3.14, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-methyl-3-phenylbenzamide is sourced from PubChem (CID 68748866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).