5,8-dimethoxyquinoline-2-carboxamide

C12H12N2O3 — CID 82242899

IUPAC5,8-dimethoxyquinoline-2-carboxamide
SMILESCOc1ccc(OC)c2nc(C(N)=O)ccc12
InChIInChI=1S/C12H12N2O3/c1-16-9-5-6-10(17-2)11-7(9)3-4-8(14-11)12(13)15/h3-6H,1-2H3,(H2,13,15)
InChIKeyWRHBXTNPEQUBJC-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.35
Rot. Bonds3

About 5,8-dimethoxyquinoline-2-carboxamide

5,8-dimethoxyquinoline-2-carboxamide (PubChem CID 82242899) has the molecular formula C12H12N2O3 and a molecular weight of 232.24 g/mol. Its IUPAC name is 5,8-dimethoxyquinoline-2-carboxamide.

Molecular Properties

Compound Name5,8-dimethoxyquinoline-2-carboxamide
PubChem CID82242899
Molecular FormulaC12H12N2O3
Molecular Weight232.24 g/mol
Exact Mass232.08
IUPAC Name5,8-dimethoxyquinoline-2-carboxamide
SMILESCOc1ccc(OC)c2nc(C(N)=O)ccc12
InChIInChI=1S/C12H12N2O3/c1-16-9-5-6-10(17-2)11-7(9)3-4-8(14-11)12(13)15/h3-6H,1-2H3,(H2,13,15)
InChIKeyWRHBXTNPEQUBJC-UHFFFAOYSA-N
XLogP1.35
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,8-dimethoxyquinoline-2-carboxamide?
The IUPAC name of 5,8-dimethoxyquinoline-2-carboxamide (CID 82242899) is 5,8-dimethoxyquinoline-2-carboxamide.
What is the SMILES notation for 5,8-dimethoxyquinoline-2-carboxamide?
The canonical SMILES for 5,8-dimethoxyquinoline-2-carboxamide is COc1ccc(OC)c2nc(C(N)=O)ccc12.
What is the InChIKey of 5,8-dimethoxyquinoline-2-carboxamide?
The InChIKey is WRHBXTNPEQUBJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3/c1-16-9-5-6-10(17-2)11-7(9)3-4-8(14-11)12(13)15/h3-6H,1-2H3,(H2,13,15).
What are the key properties of 5,8-dimethoxyquinoline-2-carboxamide?
5,8-dimethoxyquinoline-2-carboxamide has a molecular weight of 232.24 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dimethoxyquinoline-2-carboxamide is sourced from PubChem (CID 82242899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).