4-dimethylsilyloxyaniline

C8H13NOSi — CID 71361253

IUPAC4-dimethylsilyloxyaniline
SMILESC[SiH](C)Oc1ccc(N)cc1
InChIInChI=1S/C8H13NOSi/c1-11(2)10-8-5-3-7(9)4-6-8/h3-6,11H,9H2,1-2H3
InChIKeyWWBPNLAHHCMPJF-UHFFFAOYSA-N
MW167.28 g/mol
LogP1.63
Rot. Bonds2

About 4-dimethylsilyloxyaniline

4-dimethylsilyloxyaniline (PubChem CID 71361253) has the molecular formula C8H13NOSi and a molecular weight of 167.28 g/mol. Its IUPAC name is 4-dimethylsilyloxyaniline.

Molecular Properties

Compound Name4-dimethylsilyloxyaniline
PubChem CID71361253
Molecular FormulaC8H13NOSi
Molecular Weight167.28 g/mol
Exact Mass167.08
IUPAC Name4-dimethylsilyloxyaniline
SMILESC[SiH](C)Oc1ccc(N)cc1
InChIInChI=1S/C8H13NOSi/c1-11(2)10-8-5-3-7(9)4-6-8/h3-6,11H,9H2,1-2H3
InChIKeyWWBPNLAHHCMPJF-UHFFFAOYSA-N
XLogP1.63
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.28
LogP ≤ 51.63
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-dimethylsilyloxyaniline?
The IUPAC name of 4-dimethylsilyloxyaniline (CID 71361253) is 4-dimethylsilyloxyaniline.
What is the SMILES notation for 4-dimethylsilyloxyaniline?
The canonical SMILES for 4-dimethylsilyloxyaniline is C[SiH](C)Oc1ccc(N)cc1.
What is the InChIKey of 4-dimethylsilyloxyaniline?
The InChIKey is WWBPNLAHHCMPJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NOSi/c1-11(2)10-8-5-3-7(9)4-6-8/h3-6,11H,9H2,1-2H3.
What are the key properties of 4-dimethylsilyloxyaniline?
4-dimethylsilyloxyaniline has a molecular weight of 167.28 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dimethylsilyloxyaniline is sourced from PubChem (CID 71361253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).