4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one

C19H17NO3 — CID 90026274

IUPAC4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one
SMILESCOc1cc(=O)n(C)cc1-c1ccccc1Oc1ccccc1
InChIInChI=1S/C19H17NO3/c1-20-13-16(18(22-2)12-19(20)21)15-10-6-7-11-17(15)23-14-8-4-3-5-9-14/h3-13H,1-2H3
InChIKeyDUSZVYZJMHSZSW-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.85
Rot. Bonds4

About 4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one

4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one (PubChem CID 90026274) has the molecular formula C19H17NO3 and a molecular weight of 307.35 g/mol. Its IUPAC name is 4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one.

Molecular Properties

Compound Name4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one
PubChem CID90026274
Molecular FormulaC19H17NO3
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC Name4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one
SMILESCOc1cc(=O)n(C)cc1-c1ccccc1Oc1ccccc1
InChIInChI=1S/C19H17NO3/c1-20-13-16(18(22-2)12-19(20)21)15-10-6-7-11-17(15)23-14-8-4-3-5-9-14/h3-13H,1-2H3
InChIKeyDUSZVYZJMHSZSW-UHFFFAOYSA-N
XLogP3.85
TPSA40.46 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one?
The IUPAC name of 4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one (CID 90026274) is 4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one.
What is the SMILES notation for 4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one?
The canonical SMILES for 4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one is COc1cc(=O)n(C)cc1-c1ccccc1Oc1ccccc1.
What is the InChIKey of 4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one?
The InChIKey is DUSZVYZJMHSZSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3/c1-20-13-16(18(22-2)12-19(20)21)15-10-6-7-11-17(15)23-14-8-4-3-5-9-14/h3-13H,1-2H3.
What are the key properties of 4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one?
4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one has a molecular weight of 307.35 g/mol, XLogP of 3.85, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-methyl-5-(2-phenoxyphenyl)pyridin-2-one is sourced from PubChem (CID 90026274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).