4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol

C22H33NO2Si — CID 69028673

IUPAC4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol
SMILESCC(C)(C)[Si](OCCNCCCCO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H33NO2Si/c1-22(2,3)26(20-12-6-4-7-13-20,21-14-8-5-9-15-21)25-19-17-23-16-10-11-18-24/h4-9,12-15,23-24H,10-11,16-19H2,1-3H3
InChIKeyZJTOFFGZFFBVKR-UHFFFAOYSA-N
MW371.60 g/mol
LogP2.93
Rot. Bonds10

About 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol

4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol (PubChem CID 69028673) has the molecular formula C22H33NO2Si and a molecular weight of 371.60 g/mol. Its IUPAC name is 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol.

Molecular Properties

Compound Name4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol
PubChem CID69028673
Molecular FormulaC22H33NO2Si
Molecular Weight371.60 g/mol
Exact Mass371.23
IUPAC Name4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol
SMILESCC(C)(C)[Si](OCCNCCCCO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H33NO2Si/c1-22(2,3)26(20-12-6-4-7-13-20,21-14-8-5-9-15-21)25-19-17-23-16-10-11-18-24/h4-9,12-15,23-24H,10-11,16-19H2,1-3H3
InChIKeyZJTOFFGZFFBVKR-UHFFFAOYSA-N
XLogP2.93
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.60
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol 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 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol?
The IUPAC name of 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol (CID 69028673) is 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol.
What is the SMILES notation for 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol?
The canonical SMILES for 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol is CC(C)(C)[Si](OCCNCCCCO)(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol?
The InChIKey is ZJTOFFGZFFBVKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H33NO2Si/c1-22(2,3)26(20-12-6-4-7-13-20,21-14-8-5-9-15-21)25-19-17-23-16-10-11-18-24/h4-9,12-15,23-24H,10-11,16-19H2,1-3H3.
What are the key properties of 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol?
4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol has a molecular weight of 371.60 g/mol, XLogP of 2.93, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]butan-1-ol is sourced from PubChem (CID 69028673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).