About (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide
(3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide (PubChem CID 95292808) has the molecular formula C19H20N2O3
and a molecular weight of 324.38 g/mol. Its IUPAC name is (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide.
Molecular Properties
| Compound Name | (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide |
| PubChem CID | 95292808 |
| Molecular Formula | C19H20N2O3 |
| Molecular Weight | 324.38 g/mol |
| Exact Mass | 324.15 |
| IUPAC Name | (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide |
| SMILES | CN(C(=O)[C@@H]1CCC(=O)NC1)c1ccc(Oc2ccccc2)cc1 |
| InChI | InChI=1S/C19H20N2O3/c1-21(19(23)14-7-12-18(22)20-13-14)15-8-10-17(11-9-15)24-16-5-3-2-4-6-16/h2-6,8-11,14H,7,12-13H2,1H3,(H,20,22)/t14-/m1/s1 |
| InChIKey | WCSMUUQPUWPQQK-CQSZACIVSA-N |
| XLogP | 2.97 |
| TPSA | 58.64 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 324.38 |
| LogP ≤ 5 | 2.97 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide (CID 95292808) is (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide is CN(C(=O)[C@@H]1CCC(=O)NC1)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide?
The InChIKey is WCSMUUQPUWPQQK-CQSZACIVSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-21(19(23)14-7-12-18(22)20-13-14)15-8-10-17(11-9-15)24-16-5-3-2-4-6-16/h2-6,8-11,14H,7,12-13H2,1H3,(H,20,22)/t14-/m1/s1.
What are the key properties of (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide?
(3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 95292808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).