2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one

C12H23NO3Si — CID 11777247

IUPAC2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one
SMILESCC(C)C(C1C=CC(=O)O1)N(C)O[Si](C)(C)C
InChIInChI=1S/C12H23NO3Si/c1-9(2)12(10-7-8-11(14)15-10)13(3)16-17(4,5)6/h7-10,12H,1-6H3
InChIKeyVIFNEXJCTYADNL-UHFFFAOYSA-N
MW257.41 g/mol
LogP2.19
Rot. Bonds5

About 2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one

2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one (PubChem CID 11777247) has the molecular formula C12H23NO3Si and a molecular weight of 257.41 g/mol. Its IUPAC name is 2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one.

Molecular Properties

Compound Name2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one
PubChem CID11777247
Molecular FormulaC12H23NO3Si
Molecular Weight257.41 g/mol
Exact Mass257.14
IUPAC Name2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one
SMILESCC(C)C(C1C=CC(=O)O1)N(C)O[Si](C)(C)C
InChIInChI=1S/C12H23NO3Si/c1-9(2)12(10-7-8-11(14)15-10)13(3)16-17(4,5)6/h7-10,12H,1-6H3
InChIKeyVIFNEXJCTYADNL-UHFFFAOYSA-N
XLogP2.19
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.41
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2,2-dimethyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one
CID 10378504

Frequently Asked Questions

What is the IUPAC name of 2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one?
The IUPAC name of 2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one (CID 11777247) is 2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one.
What is the SMILES notation for 2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one?
The canonical SMILES for 2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one is CC(C)C(C1C=CC(=O)O1)N(C)O[Si](C)(C)C.
What is the InChIKey of 2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one?
The InChIKey is VIFNEXJCTYADNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3Si/c1-9(2)12(10-7-8-11(14)15-10)13(3)16-17(4,5)6/h7-10,12H,1-6H3.
What are the key properties of 2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one?
2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one has a molecular weight of 257.41 g/mol, XLogP of 2.19, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-1-[methyl(trimethylsilyloxy)amino]propyl]-2H-furan-5-one is sourced from PubChem (CID 11777247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).