4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one

C16H13NO2 — CID 54676589

IUPAC4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one
SMILESCc1ccc2[nH]c(=O)c(-c3ccccc3)c(O)c2c1
InChIInChI=1S/C16H13NO2/c1-10-7-8-13-12(9-10)15(18)14(16(19)17-13)11-5-3-2-4-6-11/h2-9H,1H3,(H2,17,18,19)
InChIKeyFQYBPRQONMOSLN-UHFFFAOYSA-N
MW251.28 g/mol
LogP3.21
Rot. Bonds1

About 4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one

4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one (PubChem CID 54676589) has the molecular formula C16H13NO2 and a molecular weight of 251.28 g/mol. Its IUPAC name is 4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one.

Molecular Properties

Compound Name4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one
PubChem CID54676589
Molecular FormulaC16H13NO2
Molecular Weight251.28 g/mol
Exact Mass251.09
IUPAC Name4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one
SMILESCc1ccc2[nH]c(=O)c(-c3ccccc3)c(O)c2c1
InChIInChI=1S/C16H13NO2/c1-10-7-8-13-12(9-10)15(18)14(16(19)17-13)11-5-3-2-4-6-11/h2-9H,1H3,(H2,17,18,19)
InChIKeyFQYBPRQONMOSLN-UHFFFAOYSA-N
XLogP3.21
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one?
The IUPAC name of 4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one (CID 54676589) is 4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one.
What is the SMILES notation for 4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one?
The canonical SMILES for 4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one is Cc1ccc2[nH]c(=O)c(-c3ccccc3)c(O)c2c1.
What is the InChIKey of 4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one?
The InChIKey is FQYBPRQONMOSLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO2/c1-10-7-8-13-12(9-10)15(18)14(16(19)17-13)11-5-3-2-4-6-11/h2-9H,1H3,(H2,17,18,19).
What are the key properties of 4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one?
4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one has a molecular weight of 251.28 g/mol, XLogP of 3.21, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one is sourced from PubChem (CID 54676589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).