About 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one
4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one (PubChem CID 142303338) has the molecular formula C18H15NO
and a molecular weight of 261.32 g/mol. Its IUPAC name is 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one.
Molecular Properties
| Compound Name | 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one |
| PubChem CID | 142303338 |
| Molecular Formula | C18H15NO |
| Molecular Weight | 261.32 g/mol |
| Exact Mass | 261.12 |
| IUPAC Name | 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one |
| SMILES | C=C(C)c1c(-c2ccccc2)c2ccccc2[nH]c1=O |
| InChI | InChI=1S/C18H15NO/c1-12(2)16-17(13-8-4-3-5-9-13)14-10-6-7-11-15(14)19-18(16)20/h3-11H,1H2,2H3,(H,19,20) |
| InChIKey | XTZSDQCIHVSXSF-UHFFFAOYSA-N |
| XLogP | 4.23 |
| TPSA | 32.86 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 261.32 |
| LogP ≤ 5 | 4.23 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one?
The IUPAC name of 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one (CID 142303338) is 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one.
What is the SMILES notation for 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one?
The canonical SMILES for 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one is C=C(C)c1c(-c2ccccc2)c2ccccc2[nH]c1=O.
What is the InChIKey of 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one?
The InChIKey is XTZSDQCIHVSXSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO/c1-12(2)16-17(13-8-4-3-5-9-13)14-10-6-7-11-15(14)19-18(16)20/h3-11H,1H2,2H3,(H,19,20).
What are the key properties of 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one?
4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one has a molecular weight of 261.32 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one is sourced from PubChem (CID 142303338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).