About 7-chloro-8-methylidenequinolin-2-one
7-chloro-8-methylidenequinolin-2-one (PubChem CID 71650467) has the molecular formula C10H6ClNO
and a molecular weight of 191.62 g/mol. Its IUPAC name is 7-chloro-8-methylidenequinolin-2-one.
Molecular Properties
| Compound Name | 7-chloro-8-methylidenequinolin-2-one |
| PubChem CID | 71650467 |
| Molecular Formula | C10H6ClNO |
| Molecular Weight | 191.62 g/mol |
| Exact Mass | 191.01 |
| IUPAC Name | 7-chloro-8-methylidenequinolin-2-one |
| SMILES | C=c1c(Cl)ccc2c1=NC(=O)C=C2 |
| InChI | InChI=1S/C10H6ClNO/c1-6-8(11)4-2-7-3-5-9(13)12-10(6)7/h2-5H,1H2 |
| InChIKey | UESFJIVDCHZCAX-UHFFFAOYSA-N |
| XLogP | 0.92 |
| TPSA | 29.43 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 191.62 |
| LogP ≤ 5 | 0.92 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 7-chloro-8-methylidenequinolin-2-one?
The IUPAC name of 7-chloro-8-methylidenequinolin-2-one (CID 71650467) is 7-chloro-8-methylidenequinolin-2-one.
What is the SMILES notation for 7-chloro-8-methylidenequinolin-2-one?
The canonical SMILES for 7-chloro-8-methylidenequinolin-2-one is C=c1c(Cl)ccc2c1=NC(=O)C=C2.
What is the InChIKey of 7-chloro-8-methylidenequinolin-2-one?
The InChIKey is UESFJIVDCHZCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClNO/c1-6-8(11)4-2-7-3-5-9(13)12-10(6)7/h2-5H,1H2.
What are the key properties of 7-chloro-8-methylidenequinolin-2-one?
7-chloro-8-methylidenequinolin-2-one has a molecular weight of 191.62 g/mol, XLogP of 0.92, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-8-methylidenequinolin-2-one is sourced from PubChem (CID 71650467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).