[amino-(dimethoxymethyl)-propylsilyl]benzene

C12H21NO2Si — CID 174829506

IUPAC[amino-(dimethoxymethyl)-propylsilyl]benzene
SMILESCCC[Si](N)(c1ccccc1)C(OC)OC
InChIInChI=1S/C12H21NO2Si/c1-4-10-16(13,12(14-2)15-3)11-8-6-5-7-9-11/h5-9,12H,4,10,13H2,1-3H3
InChIKeyZIIOFHIYLJBXHP-UHFFFAOYSA-N
MW239.39 g/mol
LogP1.37
Rot. Bonds6

About [amino-(dimethoxymethyl)-propylsilyl]benzene

[amino-(dimethoxymethyl)-propylsilyl]benzene (PubChem CID 174829506) has the molecular formula C12H21NO2Si and a molecular weight of 239.39 g/mol. Its IUPAC name is [amino-(dimethoxymethyl)-propylsilyl]benzene.

Molecular Properties

Compound Name[amino-(dimethoxymethyl)-propylsilyl]benzene
PubChem CID174829506
Molecular FormulaC12H21NO2Si
Molecular Weight239.39 g/mol
Exact Mass239.13
IUPAC Name[amino-(dimethoxymethyl)-propylsilyl]benzene
SMILESCCC[Si](N)(c1ccccc1)C(OC)OC
InChIInChI=1S/C12H21NO2Si/c1-4-10-16(13,12(14-2)15-3)11-8-6-5-7-9-11/h5-9,12H,4,10,13H2,1-3H3
InChIKeyZIIOFHIYLJBXHP-UHFFFAOYSA-N
XLogP1.37
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.39
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze [amino-(dimethoxymethyl)-propylsilyl]benzene 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 [amino-(dimethoxymethyl)-propylsilyl]benzene?
The IUPAC name of [amino-(dimethoxymethyl)-propylsilyl]benzene (CID 174829506) is [amino-(dimethoxymethyl)-propylsilyl]benzene.
What is the SMILES notation for [amino-(dimethoxymethyl)-propylsilyl]benzene?
The canonical SMILES for [amino-(dimethoxymethyl)-propylsilyl]benzene is CCC[Si](N)(c1ccccc1)C(OC)OC.
What is the InChIKey of [amino-(dimethoxymethyl)-propylsilyl]benzene?
The InChIKey is ZIIOFHIYLJBXHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2Si/c1-4-10-16(13,12(14-2)15-3)11-8-6-5-7-9-11/h5-9,12H,4,10,13H2,1-3H3.
What are the key properties of [amino-(dimethoxymethyl)-propylsilyl]benzene?
[amino-(dimethoxymethyl)-propylsilyl]benzene has a molecular weight of 239.39 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [amino-(dimethoxymethyl)-propylsilyl]benzene is sourced from PubChem (CID 174829506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).