About N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide
N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide (PubChem CID 57363396) has the molecular formula C19H21NO2
and a molecular weight of 295.38 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide.
Molecular Properties
| Compound Name | N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide |
| PubChem CID | 57363396 |
| Molecular Formula | C19H21NO2 |
| Molecular Weight | 295.38 g/mol |
| Exact Mass | 295.16 |
| IUPAC Name | N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide |
| SMILES | COc1ccc(N(C=O)C2(c3ccccc3)CCCC2)cc1 |
| InChI | InChI=1S/C19H21NO2/c1-22-18-11-9-17(10-12-18)20(15-21)19(13-5-6-14-19)16-7-3-2-4-8-16/h2-4,7-12,15H,5-6,13-14H2,1H3 |
| InChIKey | WYTHMDXCPSKRJN-UHFFFAOYSA-N |
| XLogP | 4.13 |
| TPSA | 29.54 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 295.38 |
| LogP ≤ 5 | 4.13 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aldehyde', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide?
The IUPAC name of N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide (CID 57363396) is N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide.
What is the SMILES notation for N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide?
The canonical SMILES for N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide is COc1ccc(N(C=O)C2(c3ccccc3)CCCC2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide?
The InChIKey is WYTHMDXCPSKRJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c1-22-18-11-9-17(10-12-18)20(15-21)19(13-5-6-14-19)16-7-3-2-4-8-16/h2-4,7-12,15H,5-6,13-14H2,1H3.
What are the key properties of N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide?
N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide has a molecular weight of 295.38 g/mol, XLogP of 4.13, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-N-(1-phenylcyclopentyl)formamide is sourced from PubChem (CID 57363396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).