Cinoxacin

C₁₂H₁₀N₂O₅ — CID 2762

About Cinoxacin

Cinoxacin (PubChem CID 2762) has the molecular formula C₁₂H₁₀N₂O₅ and a molecular weight of 262.22 g/mol. Its IUPAC name is 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid.

Molecular Properties

• Compound Name: Cinoxacin
• PubChem CID: 2762
• Molecular Formula: C₁₂H₁₀N₂O₅
• Molecular Weight: 262.22 g/mol
• Exact Mass: 262.06
• IUPAC Name: 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
• SMILES: CCn1nc(C(=O)O)c(=O)c2cc3c(cc21)OCO3
• InChI: InChI=1S/C12H10N2O5/c1-2-14-7-4-9-8(18-5-19-9)3-6(7)11(15)10(13-14)12(16)17/h3-4H,2,5H2,1H3,(H,16,17)
• InChIKey: VDUWPHTZYNWKRN-UHFFFAOYSA-N
• XLogP: 0.84
• TPSA: 90.65 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 2
• Heavy Atoms: 19
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	262.22
LogP ≤ 5	0.84
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of Cinoxacin?

The IUPAC name of Cinoxacin (CID 2762) is 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid.

What is the SMILES notation for Cinoxacin?

The canonical SMILES for Cinoxacin is CCn1nc(C(=O)O)c(=O)c2cc3c(cc21)OCO3.

What is the InChIKey of Cinoxacin?

The InChIKey is VDUWPHTZYNWKRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O5/c1-2-14-7-4-9-8(18-5-19-9)3-6(7)11(15)10(13-14)12(16)17/h3-4H,2,5H2,1H3,(H,16,17).

What are the key properties of Cinoxacin?

Cinoxacin has a molecular weight of 262.22 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for Cinoxacin is sourced from PubChem (CID 2762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 2762 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 657 — approved-drug record (CC BY-SA 4.0)

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