3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one

C18H15NO2 — CID 90026512

IUPAC3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one
SMILESCc1cc(-c2ccccc2Oc2ccccc2)c[nH]c1=O
InChIInChI=1S/C18H15NO2/c1-13-11-14(12-19-18(13)20)16-9-5-6-10-17(16)21-15-7-3-2-4-8-15/h2-12H,1H3,(H,19,20)
InChIKeyZQYOXBNCDYICCV-UHFFFAOYSA-N
MW277.32 g/mol
LogP4.14
Rot. Bonds3

About 3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one

3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one (PubChem CID 90026512) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is 3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one
PubChem CID90026512
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC Name3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one
SMILESCc1cc(-c2ccccc2Oc2ccccc2)c[nH]c1=O
InChIInChI=1S/C18H15NO2/c1-13-11-14(12-19-18(13)20)16-9-5-6-10-17(16)21-15-7-3-2-4-8-15/h2-12H,1H3,(H,19,20)
InChIKeyZQYOXBNCDYICCV-UHFFFAOYSA-N
XLogP4.14
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one?
The IUPAC name of 3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one (CID 90026512) is 3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one.
What is the SMILES notation for 3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one?
The canonical SMILES for 3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one is Cc1cc(-c2ccccc2Oc2ccccc2)c[nH]c1=O.
What is the InChIKey of 3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one?
The InChIKey is ZQYOXBNCDYICCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO2/c1-13-11-14(12-19-18(13)20)16-9-5-6-10-17(16)21-15-7-3-2-4-8-15/h2-12H,1H3,(H,19,20).
What are the key properties of 3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one?
3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one has a molecular weight of 277.32 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(2-phenoxyphenyl)-1H-pyridin-2-one is sourced from PubChem (CID 90026512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).