5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one

C16H21NO3Si — CID 137330387

IUPAC5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one
SMILESCC[SiH](C)c1ccc(OC)c(-c2cc(O)c(=O)n(C)c2)c1
InChIInChI=1S/C16H21NO3Si/c1-5-21(4)12-6-7-15(20-3)13(9-12)11-8-14(18)16(19)17(2)10-11/h6-10,18,21H,5H2,1-4H3
InChIKeyXZZBHKJVMZMHGZ-UHFFFAOYSA-N
MW303.43 g/mol
LogP1.85
Rot. Bonds4

About 5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one

5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one (PubChem CID 137330387) has the molecular formula C16H21NO3Si and a molecular weight of 303.43 g/mol. Its IUPAC name is 5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one.

Molecular Properties

Compound Name5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one
PubChem CID137330387
Molecular FormulaC16H21NO3Si
Molecular Weight303.43 g/mol
Exact Mass303.13
IUPAC Name5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one
SMILESCC[SiH](C)c1ccc(OC)c(-c2cc(O)c(=O)n(C)c2)c1
InChIInChI=1S/C16H21NO3Si/c1-5-21(4)12-6-7-15(20-3)13(9-12)11-8-14(18)16(19)17(2)10-11/h6-10,18,21H,5H2,1-4H3
InChIKeyXZZBHKJVMZMHGZ-UHFFFAOYSA-N
XLogP1.85
TPSA51.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.43
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one?
The IUPAC name of 5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one (CID 137330387) is 5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one.
What is the SMILES notation for 5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one?
The canonical SMILES for 5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one is CC[SiH](C)c1ccc(OC)c(-c2cc(O)c(=O)n(C)c2)c1.
What is the InChIKey of 5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one?
The InChIKey is XZZBHKJVMZMHGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO3Si/c1-5-21(4)12-6-7-15(20-3)13(9-12)11-8-14(18)16(19)17(2)10-11/h6-10,18,21H,5H2,1-4H3.
What are the key properties of 5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one?
5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one has a molecular weight of 303.43 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-[ethyl(methyl)silyl]-2-methoxyphenyl]-3-hydroxy-1-methylpyridin-2-one is sourced from PubChem (CID 137330387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).