2-[3-[dimethyl(phenyl)silyl]propyl]phenol

C17H22OSi — CID 23541385

IUPAC2-[3-[dimethyl(phenyl)silyl]propyl]phenol
SMILESC[Si](C)(CCCc1ccccc1O)c1ccccc1
InChIInChI=1S/C17H22OSi/c1-19(2,16-11-4-3-5-12-16)14-8-10-15-9-6-7-13-17(15)18/h3-7,9,11-13,18H,8,10,14H2,1-2H3
InChIKeyNVBIMIZNQPHDKM-UHFFFAOYSA-N
MW270.45 g/mol
LogP3.94
Rot. Bonds5

About 2-[3-[dimethyl(phenyl)silyl]propyl]phenol

2-[3-[dimethyl(phenyl)silyl]propyl]phenol (PubChem CID 23541385) has the molecular formula C17H22OSi and a molecular weight of 270.45 g/mol. Its IUPAC name is 2-[3-[dimethyl(phenyl)silyl]propyl]phenol.

Molecular Properties

Compound Name2-[3-[dimethyl(phenyl)silyl]propyl]phenol
PubChem CID23541385
Molecular FormulaC17H22OSi
Molecular Weight270.45 g/mol
Exact Mass270.14
IUPAC Name2-[3-[dimethyl(phenyl)silyl]propyl]phenol
SMILESC[Si](C)(CCCc1ccccc1O)c1ccccc1
InChIInChI=1S/C17H22OSi/c1-19(2,16-11-4-3-5-12-16)14-8-10-15-9-6-7-13-17(15)18/h3-7,9,11-13,18H,8,10,14H2,1-2H3
InChIKeyNVBIMIZNQPHDKM-UHFFFAOYSA-N
XLogP3.94
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.45
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-[3-[dimethyl(phenyl)silyl]propyl]phenol 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-[3-[dimethyl(phenyl)silyl]propyl]phenol?
The IUPAC name of 2-[3-[dimethyl(phenyl)silyl]propyl]phenol (CID 23541385) is 2-[3-[dimethyl(phenyl)silyl]propyl]phenol.
What is the SMILES notation for 2-[3-[dimethyl(phenyl)silyl]propyl]phenol?
The canonical SMILES for 2-[3-[dimethyl(phenyl)silyl]propyl]phenol is C[Si](C)(CCCc1ccccc1O)c1ccccc1.
What is the InChIKey of 2-[3-[dimethyl(phenyl)silyl]propyl]phenol?
The InChIKey is NVBIMIZNQPHDKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22OSi/c1-19(2,16-11-4-3-5-12-16)14-8-10-15-9-6-7-13-17(15)18/h3-7,9,11-13,18H,8,10,14H2,1-2H3.
What are the key properties of 2-[3-[dimethyl(phenyl)silyl]propyl]phenol?
2-[3-[dimethyl(phenyl)silyl]propyl]phenol has a molecular weight of 270.45 g/mol, XLogP of 3.94, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[dimethyl(phenyl)silyl]propyl]phenol is sourced from PubChem (CID 23541385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).