5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one

C14H18FNO3Si — CID 140833680

IUPAC5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one
SMILESCC1(c2ccc(F)cc2)OC(N)=C(O[Si](C)(C)C)C1=O
InChIInChI=1S/C14H18FNO3Si/c1-14(9-5-7-10(15)8-6-9)12(17)11(13(16)18-14)19-20(2,3)4/h5-8H,16H2,1-4H3
InChIKeyVQBYOXYWNGZJGD-UHFFFAOYSA-N
MW295.39 g/mol
LogP2.62
Rot. Bonds3

About 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one

5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one (PubChem CID 140833680) has the molecular formula C14H18FNO3Si and a molecular weight of 295.39 g/mol. Its IUPAC name is 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one.

Molecular Properties

Compound Name5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one
PubChem CID140833680
Molecular FormulaC14H18FNO3Si
Molecular Weight295.39 g/mol
Exact Mass295.10
IUPAC Name5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one
SMILESCC1(c2ccc(F)cc2)OC(N)=C(O[Si](C)(C)C)C1=O
InChIInChI=1S/C14H18FNO3Si/c1-14(9-5-7-10(15)8-6-9)12(17)11(13(16)18-14)19-20(2,3)4/h5-8H,16H2,1-4H3
InChIKeyVQBYOXYWNGZJGD-UHFFFAOYSA-N
XLogP2.62
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-2-(3-chloro-4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one
CID 90081265
5-amino-2-(3-chlorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one
CID 90080344
5-amino-2-(2-chlorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one
CID 90080941
5-amino-2-(2,3-dichlorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one
CID 90082115
5-amino-2-(3,4-difluorophenyl)-4-hydroxy-2-methylfuran-3-one
CID 90082264
[2-[ethylsulfonyl(methyl)amino]-5-(4-fluorophenyl)-5-methyl-4-oxofuran-3-yl] acetate
CID 175463079
[2-amino-5-(2,3-difluorophenyl)-5-methyl-4-oxofuran-3-yl] acetate
CID 140834024
N-[5-(4-fluorophenyl)-3-hydroxy-5-methyl-4-oxofuran-2-yl]methanesulfonamide
CID 140834124
2-(4-fluorophenyl)-2-methyl-5-[(E)-2-phenylethenyl]furan-3-one
CID 11130172
5-ethenyl-2-(4-fluorophenyl)-2-methyl-1,3-benzodioxin-4-one
CID 171601580
(5R)-5-(4-fluorophenyl)-5-methyl-1,3-oxazolidin-2-one
CID 93182568
fluorobenzene;2-fluoroethenoxy(trimethyl)silane
CID 175535258

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one?
The IUPAC name of 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one (CID 140833680) is 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one.
What is the SMILES notation for 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one?
The canonical SMILES for 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one is CC1(c2ccc(F)cc2)OC(N)=C(O[Si](C)(C)C)C1=O.
What is the InChIKey of 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one?
The InChIKey is VQBYOXYWNGZJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO3Si/c1-14(9-5-7-10(15)8-6-9)12(17)11(13(16)18-14)19-20(2,3)4/h5-8H,16H2,1-4H3.
What are the key properties of 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one?
5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one has a molecular weight of 295.39 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(4-fluorophenyl)-2-methyl-4-trimethylsilyloxyfuran-3-one is sourced from PubChem (CID 140833680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).