CID 13358394

C15H17OSi — CID 13358394

IUPAC—
SMILESCC(O[Si](C)c1ccccc1)c1ccccc1
InChIInChI=1S/C15H17OSi/c1-13(14-9-5-3-6-10-14)16-17(2)15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKeyNBBNPWWIMBOMTJ-UHFFFAOYSA-N
MW241.39 g/mol
LogP3.29
Rot. Bonds4

About CID 13358394

CID 13358394 (PubChem CID 13358394) has the molecular formula C15H17OSi and a molecular weight of 241.39 g/mol.

Molecular Properties

Compound NameCID 13358394
PubChem CID13358394
Molecular FormulaC15H17OSi
Molecular Weight241.39 g/mol
Exact Mass241.10
IUPAC Name—
SMILESCC(O[Si](C)c1ccccc1)c1ccccc1
InChIInChI=1S/C15H17OSi/c1-13(14-9-5-3-6-10-14)16-17(2)15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKeyNBBNPWWIMBOMTJ-UHFFFAOYSA-N
XLogP3.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.39
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze CID 13358394 with MolForge

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

Launch Full Analysis

Related Compounds

[(1S)-1-[(E)-prop-1-enoxy]ethyl]benzene
CID 10080688
trimethyl(1-phenylethoxy)silane
CID 519015
CID 45050176
CID 45050176
1-(disulfanyloxy)ethylbenzene
CID 139459005
1-phenylethyl nitrite
CID 18989891
1-(chloromethoxy)ethylbenzene
CID 13140582
[(1R)-1-phenylethyl] formate
CID 76963066
1-phenylethoxy-di(propan-2-yl)silane
CID 173140132
1-phenylethylbenzene
CID 11918
1-phenylethylbenzene
CID 142851428
benzene;cumene
CID 157215889
cumene
CID 161227923

Frequently Asked Questions

What is the IUPAC name of CID 13358394?
The IUPAC name of CID 13358394 (CID 13358394) is not available.
What is the SMILES notation for CID 13358394?
The canonical SMILES for CID 13358394 is CC(O[Si](C)c1ccccc1)c1ccccc1.
What is the InChIKey of CID 13358394?
The InChIKey is NBBNPWWIMBOMTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17OSi/c1-13(14-9-5-3-6-10-14)16-17(2)15-11-7-4-8-12-15/h3-13H,1-2H3.
What are the key properties of CID 13358394?
CID 13358394 has a molecular weight of 241.39 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 13358394 is sourced from PubChem (CID 13358394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).