2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate

C15H25NO3Si — CID 122215971

IUPAC2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate
SMILESCC(C)(Nc1ccccc1)C(=O)OCCO[Si](C)(C)C
InChIInChI=1S/C15H25NO3Si/c1-15(2,16-13-9-7-6-8-10-13)14(17)18-11-12-19-20(3,4)5/h6-10,16H,11-12H2,1-5H3
InChIKeyYTRFMHHETVJCDA-UHFFFAOYSA-N
MW295.45 g/mol
LogP3.27
Rot. Bonds7

About 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate

2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate (PubChem CID 122215971) has the molecular formula C15H25NO3Si and a molecular weight of 295.45 g/mol. Its IUPAC name is 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate.

Molecular Properties

Compound Name2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate
PubChem CID122215971
Molecular FormulaC15H25NO3Si
Molecular Weight295.45 g/mol
Exact Mass295.16
IUPAC Name2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate
SMILESCC(C)(Nc1ccccc1)C(=O)OCCO[Si](C)(C)C
InChIInChI=1S/C15H25NO3Si/c1-15(2,16-13-9-7-6-8-10-13)14(17)18-11-12-19-20(3,4)5/h6-10,16H,11-12H2,1-5H3
InChIKeyYTRFMHHETVJCDA-UHFFFAOYSA-N
XLogP3.27
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate 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

ethyl 2-anilino-2-methylheptanoate
CID 80558019
3-[tert-butyl(dimethyl)silyl]oxypropyl N-phenylcarbamate
CID 177244740
ethyl 2-[4-(formamidomethyl)anilino]-2-methylpropanoate
CID 143723978
ethyl 2-[4-(6-amino-2-pyridinyl)anilino]-2-methylpropanoate
CID 156541037
2,2,2-trifluoroethyl 2-anilino-2-methyl-3-oxobutanoate
CID 162404580
methyl 2-anilino-2-methyloctanoate
CID 54890030
2-anilino-2-hydroxypropanoic acid
CID 159388558
ethyl 2-anilino-2-(5-bromofuran-2-yl)propanoate
CID 104653374
2-anilino-2-methyl-3-phenylpropanamide
CID 55151227
4-anilino-4-methylhexanoic acid
CID 70438970
2-anilino-2-methylpentanoic acid
CID 60992039
ethyl 2-anilino-2-[4-(trifluoromethyl)phenyl]propanoate
CID 59200602

Frequently Asked Questions

What is the IUPAC name of 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate?
The IUPAC name of 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate (CID 122215971) is 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate.
What is the SMILES notation for 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate?
The canonical SMILES for 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate is CC(C)(Nc1ccccc1)C(=O)OCCO[Si](C)(C)C.
What is the InChIKey of 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate?
The InChIKey is YTRFMHHETVJCDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3Si/c1-15(2,16-13-9-7-6-8-10-13)14(17)18-11-12-19-20(3,4)5/h6-10,16H,11-12H2,1-5H3.
What are the key properties of 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate?
2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate has a molecular weight of 295.45 g/mol, XLogP of 3.27, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylsilyloxyethyl 2-anilino-2-methylpropanoate is sourced from PubChem (CID 122215971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).