3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one

C17H15NO4 — CID 15459134

IUPAC3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one
SMILESCOc1cc2[nH]c(-c3ccccc3)c(O)c(=O)c2cc1OC
InChIInChI=1S/C17H15NO4/c1-21-13-8-11-12(9-14(13)22-2)18-15(17(20)16(11)19)10-6-4-3-5-7-10/h3-9,20H,1-2H3,(H,18,19)
InChIKeyNOWYIUZUXWKHHW-UHFFFAOYSA-N
MW297.31 g/mol
LogP2.92
Rot. Bonds3

About 3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one

3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one (PubChem CID 15459134) has the molecular formula C17H15NO4 and a molecular weight of 297.31 g/mol. Its IUPAC name is 3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one.

Molecular Properties

Compound Name3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one
PubChem CID15459134
Molecular FormulaC17H15NO4
Molecular Weight297.31 g/mol
Exact Mass297.10
IUPAC Name3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one
SMILESCOc1cc2[nH]c(-c3ccccc3)c(O)c(=O)c2cc1OC
InChIInChI=1S/C17H15NO4/c1-21-13-8-11-12(9-14(13)22-2)18-15(17(20)16(11)19)10-6-4-3-5-7-10/h3-9,20H,1-2H3,(H,18,19)
InChIKeyNOWYIUZUXWKHHW-UHFFFAOYSA-N
XLogP2.92
TPSA71.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one?
The IUPAC name of 3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one (CID 15459134) is 3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one.
What is the SMILES notation for 3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one?
The canonical SMILES for 3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one is COc1cc2[nH]c(-c3ccccc3)c(O)c(=O)c2cc1OC.
What is the InChIKey of 3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one?
The InChIKey is NOWYIUZUXWKHHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO4/c1-21-13-8-11-12(9-14(13)22-2)18-15(17(20)16(11)19)10-6-4-3-5-7-10/h3-9,20H,1-2H3,(H,18,19).
What are the key properties of 3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one?
3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one has a molecular weight of 297.31 g/mol, XLogP of 2.92, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-6,7-dimethoxy-2-phenyl-1H-quinolin-4-one is sourced from PubChem (CID 15459134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).