4-hydroxy-8-methoxy-1-methylquinolin-2-one

C11H11NO3 — CID 54708989

IUPAC4-hydroxy-8-methoxy-1-methylquinolin-2-one
SMILESCOc1cccc2c(O)cc(=O)n(C)c12
InChIInChI=1S/C11H11NO3/c1-12-10(14)6-8(13)7-4-3-5-9(15-2)11(7)12/h3-6,13H,1-2H3
InChIKeyIHANDTHWZGLKJW-UHFFFAOYSA-N
MW205.21 g/mol
LogP1.25
Rot. Bonds1

About 4-hydroxy-8-methoxy-1-methylquinolin-2-one

4-hydroxy-8-methoxy-1-methylquinolin-2-one (PubChem CID 54708989) has the molecular formula C11H11NO3 and a molecular weight of 205.21 g/mol. Its IUPAC name is 4-hydroxy-8-methoxy-1-methylquinolin-2-one.

Molecular Properties

Compound Name4-hydroxy-8-methoxy-1-methylquinolin-2-one
PubChem CID54708989
Molecular FormulaC11H11NO3
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name4-hydroxy-8-methoxy-1-methylquinolin-2-one
SMILESCOc1cccc2c(O)cc(=O)n(C)c12
InChIInChI=1S/C11H11NO3/c1-12-10(14)6-8(13)7-4-3-5-9(15-2)11(7)12/h3-6,13H,1-2H3
InChIKeyIHANDTHWZGLKJW-UHFFFAOYSA-N
XLogP1.25
TPSA51.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-8-methoxy-1-methylquinolin-2-one?
The IUPAC name of 4-hydroxy-8-methoxy-1-methylquinolin-2-one (CID 54708989) is 4-hydroxy-8-methoxy-1-methylquinolin-2-one.
What is the SMILES notation for 4-hydroxy-8-methoxy-1-methylquinolin-2-one?
The canonical SMILES for 4-hydroxy-8-methoxy-1-methylquinolin-2-one is COc1cccc2c(O)cc(=O)n(C)c12.
What is the InChIKey of 4-hydroxy-8-methoxy-1-methylquinolin-2-one?
The InChIKey is IHANDTHWZGLKJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c1-12-10(14)6-8(13)7-4-3-5-9(15-2)11(7)12/h3-6,13H,1-2H3.
What are the key properties of 4-hydroxy-8-methoxy-1-methylquinolin-2-one?
4-hydroxy-8-methoxy-1-methylquinolin-2-one has a molecular weight of 205.21 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-8-methoxy-1-methylquinolin-2-one is sourced from PubChem (CID 54708989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).