About N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide
N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide (PubChem CID 22769491) has the molecular formula C19H24N2O2
and a molecular weight of 312.41 g/mol. Its IUPAC name is N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide.
Molecular Properties
| Compound Name | N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide |
| PubChem CID | 22769491 |
| Molecular Formula | C19H24N2O2 |
| Molecular Weight | 312.41 g/mol |
| Exact Mass | 312.18 |
| IUPAC Name | N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide |
| SMILES | CC(CNC(=O)Cc1ccccc1)NCC(O)c1ccccc1 |
| InChI | InChI=1S/C19H24N2O2/c1-15(20-14-18(22)17-10-6-3-7-11-17)13-21-19(23)12-16-8-4-2-5-9-16/h2-11,15,18,20,22H,12-14H2,1H3,(H,21,23) |
| InChIKey | CPJOTJVGGVYFEF-UHFFFAOYSA-N |
| XLogP | 2.06 |
| TPSA | 61.36 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 312.41 |
| LogP ≤ 5 | 2.06 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide?
The IUPAC name of N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide (CID 22769491) is N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide?
The canonical SMILES for N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide is CC(CNC(=O)Cc1ccccc1)NCC(O)c1ccccc1.
What is the InChIKey of N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide?
The InChIKey is CPJOTJVGGVYFEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-15(20-14-18(22)17-10-6-3-7-11-17)13-21-19(23)12-16-8-4-2-5-9-16/h2-11,15,18,20,22H,12-14H2,1H3,(H,21,23).
What are the key properties of N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide?
N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide has a molecular weight of 312.41 g/mol, XLogP of 2.06, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-phenylacetamide is sourced from PubChem (CID 22769491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).