2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine

C15H26FNOSi — CID 59688027

IUPAC2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine
SMILESCC(C)(C)[Si](C)(C)OCCNCc1ccc(F)cc1
InChIInChI=1S/C15H26FNOSi/c1-15(2,3)19(4,5)18-11-10-17-12-13-6-8-14(16)9-7-13/h6-9,17H,10-12H2,1-5H3
InChIKeyFGEZJQHKLZEXSY-UHFFFAOYSA-N
MW283.46 g/mol
LogP3.94
Rot. Bonds6

About 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine

2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine (PubChem CID 59688027) has the molecular formula C15H26FNOSi and a molecular weight of 283.46 g/mol. Its IUPAC name is 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine.

Molecular Properties

Compound Name2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine
PubChem CID59688027
Molecular FormulaC15H26FNOSi
Molecular Weight283.46 g/mol
Exact Mass283.18
IUPAC Name2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine
SMILESCC(C)(C)[Si](C)(C)OCCNCc1ccc(F)cc1
InChIInChI=1S/C15H26FNOSi/c1-15(2,3)19(4,5)18-11-10-17-12-13-6-8-14(16)9-7-13/h6-9,17H,10-12H2,1-5H3
InChIKeyFGEZJQHKLZEXSY-UHFFFAOYSA-N
XLogP3.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine?
The IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine (CID 59688027) is 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine.
What is the SMILES notation for 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine?
The canonical SMILES for 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine is CC(C)(C)[Si](C)(C)OCCNCc1ccc(F)cc1.
What is the InChIKey of 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine?
The InChIKey is FGEZJQHKLZEXSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26FNOSi/c1-15(2,3)19(4,5)18-11-10-17-12-13-6-8-14(16)9-7-13/h6-9,17H,10-12H2,1-5H3.
What are the key properties of 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine?
2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine has a molecular weight of 283.46 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(dimethyl)silyl]oxy-N-[(4-fluorophenyl)methyl]ethanamine is sourced from PubChem (CID 59688027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).