4-(trimethylsilyloxymethyl)aniline

C10H17NOSi — CID 11401321

IUPAC4-(trimethylsilyloxymethyl)aniline
SMILESC[Si](C)(C)OCc1ccc(N)cc1
InChIInChI=1S/C10H17NOSi/c1-13(2,3)12-8-9-4-6-10(11)7-5-9/h4-7H,8,11H2,1-3H3
InChIKeyUMGGPDOEWATZPM-UHFFFAOYSA-N
MW195.34 g/mol
LogP2.62
Rot. Bonds3

About 4-(trimethylsilyloxymethyl)aniline

4-(trimethylsilyloxymethyl)aniline (PubChem CID 11401321) has the molecular formula C10H17NOSi and a molecular weight of 195.34 g/mol. Its IUPAC name is 4-(trimethylsilyloxymethyl)aniline.

Molecular Properties

Compound Name4-(trimethylsilyloxymethyl)aniline
PubChem CID11401321
Molecular FormulaC10H17NOSi
Molecular Weight195.34 g/mol
Exact Mass195.11
IUPAC Name4-(trimethylsilyloxymethyl)aniline
SMILESC[Si](C)(C)OCc1ccc(N)cc1
InChIInChI=1S/C10H17NOSi/c1-13(2,3)12-8-9-4-6-10(11)7-5-9/h4-7H,8,11H2,1-3H3
InChIKeyUMGGPDOEWATZPM-UHFFFAOYSA-N
XLogP2.62
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.34
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(trimethylsilyloxymethyl)aniline?
The IUPAC name of 4-(trimethylsilyloxymethyl)aniline (CID 11401321) is 4-(trimethylsilyloxymethyl)aniline.
What is the SMILES notation for 4-(trimethylsilyloxymethyl)aniline?
The canonical SMILES for 4-(trimethylsilyloxymethyl)aniline is C[Si](C)(C)OCc1ccc(N)cc1.
What is the InChIKey of 4-(trimethylsilyloxymethyl)aniline?
The InChIKey is UMGGPDOEWATZPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NOSi/c1-13(2,3)12-8-9-4-6-10(11)7-5-9/h4-7H,8,11H2,1-3H3.
What are the key properties of 4-(trimethylsilyloxymethyl)aniline?
4-(trimethylsilyloxymethyl)aniline has a molecular weight of 195.34 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(trimethylsilyloxymethyl)aniline is sourced from PubChem (CID 11401321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).