About N-[1-(4-methoxyphenyl)ethenyl]formamide
N-[1-(4-methoxyphenyl)ethenyl]formamide (PubChem CID 14117206) has the molecular formula C10H11NO2
and a molecular weight of 177.20 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)ethenyl]formamide.
Molecular Properties
| Compound Name | N-[1-(4-methoxyphenyl)ethenyl]formamide |
| PubChem CID | 14117206 |
| Molecular Formula | C10H11NO2 |
| Molecular Weight | 177.20 g/mol |
| Exact Mass | 177.08 |
| IUPAC Name | N-[1-(4-methoxyphenyl)ethenyl]formamide |
| SMILES | C=C(NC=O)c1ccc(OC)cc1 |
| InChI | InChI=1S/C10H11NO2/c1-8(11-7-12)9-3-5-10(13-2)6-4-9/h3-7H,1H2,2H3,(H,11,12) |
| InChIKey | LKHNOINNBMRTMV-UHFFFAOYSA-N |
| XLogP | 1.41 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 177.20 |
| LogP ≤ 5 | 1.41 |
| H-Bond Donors ≤ 5 | 1 |
| 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-[1-(4-methoxyphenyl)ethenyl]formamide?
The IUPAC name of N-[1-(4-methoxyphenyl)ethenyl]formamide (CID 14117206) is N-[1-(4-methoxyphenyl)ethenyl]formamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)ethenyl]formamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)ethenyl]formamide is C=C(NC=O)c1ccc(OC)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)ethenyl]formamide?
The InChIKey is LKHNOINNBMRTMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-8(11-7-12)9-3-5-10(13-2)6-4-9/h3-7H,1H2,2H3,(H,11,12).
What are the key properties of N-[1-(4-methoxyphenyl)ethenyl]formamide?
N-[1-(4-methoxyphenyl)ethenyl]formamide has a molecular weight of 177.20 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)ethenyl]formamide is sourced from PubChem (CID 14117206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).