N-dimethoxysilylaniline

C₈H₁₃NO₂Si — CID 154073856

About N-dimethoxysilylaniline

N-dimethoxysilylaniline (PubChem CID 154073856) has the molecular formula C₈H₁₃NO₂Si and a molecular weight of 183.28 g/mol. Its IUPAC name is N-dimethoxysilylaniline.

Molecular Properties

• Compound Name: N-dimethoxysilylaniline
• PubChem CID: 154073856
• Molecular Formula: C₈H₁₃NO₂Si
• Molecular Weight: 183.28 g/mol
• Exact Mass: 183.07
• IUPAC Name: N-dimethoxysilylaniline
• SMILES: CO[SiH](Nc1ccccc1)OC
• InChI: InChI=1S/C8H13NO2Si/c1-10-12(11-2)9-8-6-4-3-5-7-8/h3-7,9,12H,1-2H3
• InChIKey: HXHHWRDFZCMKHA-UHFFFAOYSA-N
• XLogP: 1.11
• TPSA: 30.49 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 12
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	183.28
LogP ≤ 5	1.11
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-dimethoxysilylaniline?

The IUPAC name of N-dimethoxysilylaniline (CID 154073856) is N-dimethoxysilylaniline.

What is the SMILES notation for N-dimethoxysilylaniline?

The canonical SMILES for N-dimethoxysilylaniline is CO[SiH](Nc1ccccc1)OC.

What is the InChIKey of N-dimethoxysilylaniline?

The InChIKey is HXHHWRDFZCMKHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2Si/c1-10-12(11-2)9-8-6-4-3-5-7-8/h3-7,9,12H,1-2H3.

What are the key properties of N-dimethoxysilylaniline?

N-dimethoxysilylaniline has a molecular weight of 183.28 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-dimethoxysilylaniline is sourced from PubChem (CID 154073856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 154073856 — identifiers, structure, computed properties (public domain)

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