About N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide
N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide (PubChem CID 119719407) has the molecular formula C15H21N3O3
and a molecular weight of 291.35 g/mol. Its IUPAC name is N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide.
Molecular Properties
| Compound Name | N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide |
| PubChem CID | 119719407 |
| Molecular Formula | C15H21N3O3 |
| Molecular Weight | 291.35 g/mol |
| Exact Mass | 291.16 |
| IUPAC Name | N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide |
| SMILES | CN(Cc1ccccc1)C(=O)CNC(=O)C1CNCCO1 |
| InChI | InChI=1S/C15H21N3O3/c1-18(11-12-5-3-2-4-6-12)14(19)10-17-15(20)13-9-16-7-8-21-13/h2-6,13,16H,7-11H2,1H3,(H,17,20) |
| InChIKey | ZPQBPPLGRIXJSV-UHFFFAOYSA-N |
| XLogP | -0.25 |
| TPSA | 70.67 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 291.35 |
| LogP ≤ 5 | -0.25 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide?
The IUPAC name of N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide (CID 119719407) is N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide?
The canonical SMILES for N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide is CN(Cc1ccccc1)C(=O)CNC(=O)C1CNCCO1.
What is the InChIKey of N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide?
The InChIKey is ZPQBPPLGRIXJSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-18(11-12-5-3-2-4-6-12)14(19)10-17-15(20)13-9-16-7-8-21-13/h2-6,13,16H,7-11H2,1H3,(H,17,20).
What are the key properties of N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide?
N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide has a molecular weight of 291.35 g/mol, XLogP of -0.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[benzyl(methyl)amino]-2-oxoethyl]morpholine-2-carboxamide is sourced from PubChem (CID 119719407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).