N-(1,1-dimethoxyethylsilyl)aniline

C10H17NO2Si — CID 173034998

IUPACN-(1,1-dimethoxyethylsilyl)aniline
SMILESCOC(C)(OC)[SiH2]Nc1ccccc1
InChIInChI=1S/C10H17NO2Si/c1-10(12-2,13-3)14-11-9-7-5-4-6-8-9/h4-8,11H,14H2,1-3H3
InChIKeyBXUZMZNKNUEFES-UHFFFAOYSA-N
MW211.34 g/mol
LogP1.15
Rot. Bonds5

About N-(1,1-dimethoxyethylsilyl)aniline

N-(1,1-dimethoxyethylsilyl)aniline (PubChem CID 173034998) has the molecular formula C10H17NO2Si and a molecular weight of 211.34 g/mol. Its IUPAC name is N-(1,1-dimethoxyethylsilyl)aniline.

Molecular Properties

Compound NameN-(1,1-dimethoxyethylsilyl)aniline
PubChem CID173034998
Molecular FormulaC10H17NO2Si
Molecular Weight211.34 g/mol
Exact Mass211.10
IUPAC NameN-(1,1-dimethoxyethylsilyl)aniline
SMILESCOC(C)(OC)[SiH2]Nc1ccccc1
InChIInChI=1S/C10H17NO2Si/c1-10(12-2,13-3)14-11-9-7-5-4-6-8-9/h4-8,11H,14H2,1-3H3
InChIKeyBXUZMZNKNUEFES-UHFFFAOYSA-N
XLogP1.15
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.34
LogP ≤ 51.15
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'}

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Frequently Asked Questions

What is the IUPAC name of N-(1,1-dimethoxyethylsilyl)aniline?
The IUPAC name of N-(1,1-dimethoxyethylsilyl)aniline (CID 173034998) is N-(1,1-dimethoxyethylsilyl)aniline.
What is the SMILES notation for N-(1,1-dimethoxyethylsilyl)aniline?
The canonical SMILES for N-(1,1-dimethoxyethylsilyl)aniline is COC(C)(OC)[SiH2]Nc1ccccc1.
What is the InChIKey of N-(1,1-dimethoxyethylsilyl)aniline?
The InChIKey is BXUZMZNKNUEFES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2Si/c1-10(12-2,13-3)14-11-9-7-5-4-6-8-9/h4-8,11H,14H2,1-3H3.
What are the key properties of N-(1,1-dimethoxyethylsilyl)aniline?
N-(1,1-dimethoxyethylsilyl)aniline has a molecular weight of 211.34 g/mol, XLogP of 1.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,1-dimethoxyethylsilyl)aniline is sourced from PubChem (CID 173034998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).