About N-(5-aminomorpholin-2-yl)benzamide
N-(5-aminomorpholin-2-yl)benzamide (PubChem CID 150839194) has the molecular formula C11H15N3O2
and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(5-aminomorpholin-2-yl)benzamide.
Molecular Properties
| Compound Name | N-(5-aminomorpholin-2-yl)benzamide |
| PubChem CID | 150839194 |
| Molecular Formula | C11H15N3O2 |
| Molecular Weight | 221.26 g/mol |
| Exact Mass | 221.12 |
| IUPAC Name | N-(5-aminomorpholin-2-yl)benzamide |
| SMILES | NC1COC(NC(=O)c2ccccc2)CN1 |
| InChI | InChI=1S/C11H15N3O2/c12-9-7-16-10(6-13-9)14-11(15)8-4-2-1-3-5-8/h1-5,9-10,13H,6-7,12H2,(H,14,15) |
| InChIKey | KNPSRLBNTVVHTA-UHFFFAOYSA-N |
| XLogP | -0.35 |
| TPSA | 76.38 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 221.26 |
| LogP ≤ 5 | -0.35 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-(5-aminomorpholin-2-yl)benzamide?
The IUPAC name of N-(5-aminomorpholin-2-yl)benzamide (CID 150839194) is N-(5-aminomorpholin-2-yl)benzamide.
What is the SMILES notation for N-(5-aminomorpholin-2-yl)benzamide?
The canonical SMILES for N-(5-aminomorpholin-2-yl)benzamide is NC1COC(NC(=O)c2ccccc2)CN1.
What is the InChIKey of N-(5-aminomorpholin-2-yl)benzamide?
The InChIKey is KNPSRLBNTVVHTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c12-9-7-16-10(6-13-9)14-11(15)8-4-2-1-3-5-8/h1-5,9-10,13H,6-7,12H2,(H,14,15).
What are the key properties of N-(5-aminomorpholin-2-yl)benzamide?
N-(5-aminomorpholin-2-yl)benzamide has a molecular weight of 221.26 g/mol, XLogP of -0.35, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-aminomorpholin-2-yl)benzamide is sourced from PubChem (CID 150839194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).