2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine

C15H26FNOSi — CID 106323752

IUPAC2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine
SMILESCOCCNCC(C[Si](C)(C)C)c1ccc(F)cc1
InChIInChI=1S/C15H26FNOSi/c1-18-10-9-17-11-14(12-19(2,3)4)13-5-7-15(16)8-6-13/h5-8,14,17H,9-12H2,1-4H3
InChIKeyGKTIODCEPCDFRZ-UHFFFAOYSA-N
MW283.46 g/mol
LogP3.48
Rot. Bonds8

About 2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine

2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine (PubChem CID 106323752) has the molecular formula C15H26FNOSi and a molecular weight of 283.46 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine
PubChem CID106323752
Molecular FormulaC15H26FNOSi
Molecular Weight283.46 g/mol
Exact Mass283.18
IUPAC Name2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine
SMILESCOCCNCC(C[Si](C)(C)C)c1ccc(F)cc1
InChIInChI=1S/C15H26FNOSi/c1-18-10-9-17-11-14(12-19(2,3)4)13-5-7-15(16)8-6-13/h5-8,14,17H,9-12H2,1-4H3
InChIKeyGKTIODCEPCDFRZ-UHFFFAOYSA-N
XLogP3.48
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 53.48
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'}

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine?
The IUPAC name of 2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine (CID 106323752) is 2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine.
What is the SMILES notation for 2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine?
The canonical SMILES for 2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine is COCCNCC(C[Si](C)(C)C)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine?
The InChIKey is GKTIODCEPCDFRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26FNOSi/c1-18-10-9-17-11-14(12-19(2,3)4)13-5-7-15(16)8-6-13/h5-8,14,17H,9-12H2,1-4H3.
What are the key properties of 2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine?
2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine has a molecular weight of 283.46 g/mol, XLogP of 3.48, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-(2-methoxyethyl)-3-trimethylsilylpropan-1-amine is sourced from PubChem (CID 106323752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).