[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine

C15H26FNOSi — CID 67254327

IUPAC[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine
SMILESCC(C)(C)[Si](C)(C)OCc1cc(CN)cc(CF)c1
InChIInChI=1S/C15H26FNOSi/c1-15(2,3)19(4,5)18-11-14-7-12(9-16)6-13(8-14)10-17/h6-8H,9-11,17H2,1-5H3
InChIKeyPWJLITPPZKDIQX-UHFFFAOYSA-N
MW283.46 g/mol
LogP4.14
Rot. Bonds5

About [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine

[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine (PubChem CID 67254327) has the molecular formula C15H26FNOSi and a molecular weight of 283.46 g/mol. Its IUPAC name is [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine.

Molecular Properties

Compound Name[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine
PubChem CID67254327
Molecular FormulaC15H26FNOSi
Molecular Weight283.46 g/mol
Exact Mass283.18
IUPAC Name[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine
SMILESCC(C)(C)[Si](C)(C)OCc1cc(CN)cc(CF)c1
InChIInChI=1S/C15H26FNOSi/c1-15(2,3)19(4,5)18-11-14-7-12(9-16)6-13(8-14)10-17/h6-8H,9-11,17H2,1-5H3
InChIKeyPWJLITPPZKDIQX-UHFFFAOYSA-N
XLogP4.14
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine 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 [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine?
The IUPAC name of [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine (CID 67254327) is [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine.
What is the SMILES notation for [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine?
The canonical SMILES for [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine is CC(C)(C)[Si](C)(C)OCc1cc(CN)cc(CF)c1.
What is the InChIKey of [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine?
The InChIKey is PWJLITPPZKDIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26FNOSi/c1-15(2,3)19(4,5)18-11-14-7-12(9-16)6-13(8-14)10-17/h6-8H,9-11,17H2,1-5H3.
What are the key properties of [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine?
[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine has a molecular weight of 283.46 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(fluoromethyl)phenyl]methanamine is sourced from PubChem (CID 67254327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).