4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one

C11H11NO4 — CID 139718554

IUPAC4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one
SMILESCOc1ccc2c(O)c(OC)c(=O)[nH]c2c1
InChIInChI=1S/C11H11NO4/c1-15-6-3-4-7-8(5-6)12-11(14)10(16-2)9(7)13/h3-5H,1-2H3,(H2,12,13,14)
InChIKeyYLPJEAYERGGVQF-UHFFFAOYSA-N
MW221.21 g/mol
LogP1.25
Rot. Bonds2

About 4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one

4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one (PubChem CID 139718554) has the molecular formula C11H11NO4 and a molecular weight of 221.21 g/mol. Its IUPAC name is 4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one.

Molecular Properties

Compound Name4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one
PubChem CID139718554
Molecular FormulaC11H11NO4
Molecular Weight221.21 g/mol
Exact Mass221.07
IUPAC Name4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one
SMILESCOc1ccc2c(O)c(OC)c(=O)[nH]c2c1
InChIInChI=1S/C11H11NO4/c1-15-6-3-4-7-8(5-6)12-11(14)10(16-2)9(7)13/h3-5H,1-2H3,(H2,12,13,14)
InChIKeyYLPJEAYERGGVQF-UHFFFAOYSA-N
XLogP1.25
TPSA71.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.21
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-7-methoxy-3-(2-methoxyphenyl)-1H-quinolin-2-one
CID 54691271
3-methoxy-5H-phenanthridin-6-one
CID 12706603
7-methoxy-1H-quinazoline-2,4-dione
CID 19604241
7-methoxy-1,2,3,5-tetrahydrocyclopenta[c]quinolin-4-one
CID 22462438
3-hydroxy-4-methoxy-7-octoxy-1H-quinolin-2-one
CID 139717151
4-hydroxy-3-[(4-hydroxy-6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-methoxy-1H-quinolin-2-one
CID 154585320
(7-hydroxy-4-methoxy-2-oxo-1H-quinolin-3-yl) acetate
CID 139718225
7-methoxy-1H-3,1-benzoxazine-2,4-dione
CID 14381997
2-acetyl-7-methoxy-1H-quinolin-4-one
CID 59108287
(7-methoxy-2-oxo-3-phenyl-1H-quinolin-4-yl) hydrogen carbonate
CID 134816586
7-methoxy-3-(4-methoxyphenyl)-1H-quinazoline-2,4-dione
CID 117261702
4-(3-hydroxyphenyl)-7-methoxy-1H-quinolin-2-one
CID 139956897

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one?
The IUPAC name of 4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one (CID 139718554) is 4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one.
What is the SMILES notation for 4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one?
The canonical SMILES for 4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one is COc1ccc2c(O)c(OC)c(=O)[nH]c2c1.
What is the InChIKey of 4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one?
The InChIKey is YLPJEAYERGGVQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO4/c1-15-6-3-4-7-8(5-6)12-11(14)10(16-2)9(7)13/h3-5H,1-2H3,(H2,12,13,14).
What are the key properties of 4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one?
4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one has a molecular weight of 221.21 g/mol, XLogP of 1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3,7-dimethoxy-1H-quinolin-2-one is sourced from PubChem (CID 139718554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).