About 4-chloro-2-methoxyquinoline
4-chloro-2-methoxyquinoline (PubChem CID 10965377) has the molecular formula C10H8ClNO
and a molecular weight of 193.63 g/mol. Its IUPAC name is 4-chloro-2-methoxyquinoline.
Molecular Properties
| Compound Name | 4-chloro-2-methoxyquinoline |
| PubChem CID | 10965377 |
| Molecular Formula | C10H8ClNO |
| Molecular Weight | 193.63 g/mol |
| Exact Mass | 193.03 |
| IUPAC Name | 4-chloro-2-methoxyquinoline |
| SMILES | COc1cc(Cl)c2ccccc2n1 |
| InChI | InChI=1S/C10H8ClNO/c1-13-10-6-8(11)7-4-2-3-5-9(7)12-10/h2-6H,1H3 |
| InChIKey | NRHZVBQTBUCSQH-UHFFFAOYSA-N |
| XLogP | 2.90 |
| TPSA | 22.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 193.63 |
| LogP ≤ 5 | 2.90 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-chloro-2-methoxyquinoline?
The IUPAC name of 4-chloro-2-methoxyquinoline (CID 10965377) is 4-chloro-2-methoxyquinoline.
What is the SMILES notation for 4-chloro-2-methoxyquinoline?
The canonical SMILES for 4-chloro-2-methoxyquinoline is COc1cc(Cl)c2ccccc2n1.
What is the InChIKey of 4-chloro-2-methoxyquinoline?
The InChIKey is NRHZVBQTBUCSQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNO/c1-13-10-6-8(11)7-4-2-3-5-9(7)12-10/h2-6H,1H3.
What are the key properties of 4-chloro-2-methoxyquinoline?
4-chloro-2-methoxyquinoline has a molecular weight of 193.63 g/mol, XLogP of 2.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methoxyquinoline is sourced from PubChem (CID 10965377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).