5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one

C16H13NO3 — CID 10084324

IUPAC5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one
SMILESCOc1cc(O)c2c(=O)cc(-c3ccccc3)[nH]c2c1
InChIInChI=1S/C16H13NO3/c1-20-11-7-13-16(14(18)8-11)15(19)9-12(17-13)10-5-3-2-4-6-10/h2-9,18H,1H3,(H,17,19)
InChIKeyUIAGNRUVENWKST-UHFFFAOYSA-N
MW267.28 g/mol
LogP2.91
Rot. Bonds2

About 5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one

5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one (PubChem CID 10084324) has the molecular formula C16H13NO3 and a molecular weight of 267.28 g/mol. Its IUPAC name is 5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one.

Molecular Properties

Compound Name5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one
PubChem CID10084324
Molecular FormulaC16H13NO3
Molecular Weight267.28 g/mol
Exact Mass267.09
IUPAC Name5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one
SMILESCOc1cc(O)c2c(=O)cc(-c3ccccc3)[nH]c2c1
InChIInChI=1S/C16H13NO3/c1-20-11-7-13-16(14(18)8-11)15(19)9-12(17-13)10-5-3-2-4-6-10/h2-9,18H,1H3,(H,17,19)
InChIKeyUIAGNRUVENWKST-UHFFFAOYSA-N
XLogP2.91
TPSA62.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one?
The IUPAC name of 5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one (CID 10084324) is 5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one.
What is the SMILES notation for 5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one?
The canonical SMILES for 5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one is COc1cc(O)c2c(=O)cc(-c3ccccc3)[nH]c2c1.
What is the InChIKey of 5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one?
The InChIKey is UIAGNRUVENWKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO3/c1-20-11-7-13-16(14(18)8-11)15(19)9-12(17-13)10-5-3-2-4-6-10/h2-9,18H,1H3,(H,17,19).
What are the key properties of 5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one?
5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one has a molecular weight of 267.28 g/mol, XLogP of 2.91, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-7-methoxy-2-phenyl-1H-quinolin-4-one is sourced from PubChem (CID 10084324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).