About 3-(3-chlorophenyl)-1H-quinolin-2-one
3-(3-chlorophenyl)-1H-quinolin-2-one (PubChem CID 152763617) has the molecular formula C15H10ClNO
and a molecular weight of 255.70 g/mol. Its IUPAC name is 3-(3-chlorophenyl)-1H-quinolin-2-one.
Molecular Properties
| Compound Name | 3-(3-chlorophenyl)-1H-quinolin-2-one |
| PubChem CID | 152763617 |
| Molecular Formula | C15H10ClNO |
| Molecular Weight | 255.70 g/mol |
| Exact Mass | 255.05 |
| IUPAC Name | 3-(3-chlorophenyl)-1H-quinolin-2-one |
| SMILES | O=c1[nH]c2ccccc2cc1-c1cccc(Cl)c1 |
| InChI | InChI=1S/C15H10ClNO/c16-12-6-3-5-10(8-12)13-9-11-4-1-2-7-14(11)17-15(13)18/h1-9H,(H,17,18) |
| InChIKey | LLWHNSUENRERCG-UHFFFAOYSA-N |
| XLogP | 3.85 |
| TPSA | 32.86 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 255.70 |
| LogP ≤ 5 | 3.85 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 3-(3-chlorophenyl)-1H-quinolin-2-one?
The IUPAC name of 3-(3-chlorophenyl)-1H-quinolin-2-one (CID 152763617) is 3-(3-chlorophenyl)-1H-quinolin-2-one.
What is the SMILES notation for 3-(3-chlorophenyl)-1H-quinolin-2-one?
The canonical SMILES for 3-(3-chlorophenyl)-1H-quinolin-2-one is O=c1[nH]c2ccccc2cc1-c1cccc(Cl)c1.
What is the InChIKey of 3-(3-chlorophenyl)-1H-quinolin-2-one?
The InChIKey is LLWHNSUENRERCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClNO/c16-12-6-3-5-10(8-12)13-9-11-4-1-2-7-14(11)17-15(13)18/h1-9H,(H,17,18).
What are the key properties of 3-(3-chlorophenyl)-1H-quinolin-2-one?
3-(3-chlorophenyl)-1H-quinolin-2-one has a molecular weight of 255.70 g/mol, XLogP of 3.85, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)-1H-quinolin-2-one is sourced from PubChem (CID 152763617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).