4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one

C21H21NO2 — CID 69386943

IUPAC4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one
SMILESCOc1c(-c2ccc(C)cc2)cn(C)c(=O)c1-c1ccc(C)cc1
InChIInChI=1S/C21H21NO2/c1-14-5-9-16(10-6-14)18-13-22(3)21(23)19(20(18)24-4)17-11-7-15(2)8-12-17/h5-13H,1-4H3
InChIKeyMAZLZMSEYHXDOQ-UHFFFAOYSA-N
MW319.40 g/mol
LogP4.34
Rot. Bonds3

About 4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one

4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one (PubChem CID 69386943) has the molecular formula C21H21NO2 and a molecular weight of 319.40 g/mol. Its IUPAC name is 4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one.

Molecular Properties

Compound Name4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one
PubChem CID69386943
Molecular FormulaC21H21NO2
Molecular Weight319.40 g/mol
Exact Mass319.16
IUPAC Name4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one
SMILESCOc1c(-c2ccc(C)cc2)cn(C)c(=O)c1-c1ccc(C)cc1
InChIInChI=1S/C21H21NO2/c1-14-5-9-16(10-6-14)18-13-22(3)21(23)19(20(18)24-4)17-11-7-15(2)8-12-17/h5-13H,1-4H3
InChIKeyMAZLZMSEYHXDOQ-UHFFFAOYSA-N
XLogP4.34
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one?
The IUPAC name of 4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one (CID 69386943) is 4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one.
What is the SMILES notation for 4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one?
The canonical SMILES for 4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one is COc1c(-c2ccc(C)cc2)cn(C)c(=O)c1-c1ccc(C)cc1.
What is the InChIKey of 4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one?
The InChIKey is MAZLZMSEYHXDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO2/c1-14-5-9-16(10-6-14)18-13-22(3)21(23)19(20(18)24-4)17-11-7-15(2)8-12-17/h5-13H,1-4H3.
What are the key properties of 4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one?
4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one has a molecular weight of 319.40 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-methyl-3,5-bis(4-methylphenyl)pyridin-2-one is sourced from PubChem (CID 69386943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).