4-tri(propan-2-yl)silyloxyaniline

C15H27NOSi — CID 86719492

IUPAC4-tri(propan-2-yl)silyloxyaniline
SMILESCC(C)[Si](Oc1ccc(N)cc1)(C(C)C)C(C)C
InChIInChI=1S/C15H27NOSi/c1-11(2)18(12(3)4,13(5)6)17-15-9-7-14(16)8-10-15/h7-13H,16H2,1-6H3
InChIKeyYJGSHNCJISIEOB-UHFFFAOYSA-N
MW265.47 g/mol
LogP4.82
Rot. Bonds5

About 4-tri(propan-2-yl)silyloxyaniline

4-tri(propan-2-yl)silyloxyaniline (PubChem CID 86719492) has the molecular formula C15H27NOSi and a molecular weight of 265.47 g/mol. Its IUPAC name is 4-tri(propan-2-yl)silyloxyaniline.

Molecular Properties

Compound Name4-tri(propan-2-yl)silyloxyaniline
PubChem CID86719492
Molecular FormulaC15H27NOSi
Molecular Weight265.47 g/mol
Exact Mass265.19
IUPAC Name4-tri(propan-2-yl)silyloxyaniline
SMILESCC(C)[Si](Oc1ccc(N)cc1)(C(C)C)C(C)C
InChIInChI=1S/C15H27NOSi/c1-11(2)18(12(3)4,13(5)6)17-15-9-7-14(16)8-10-15/h7-13H,16H2,1-6H3
InChIKeyYJGSHNCJISIEOB-UHFFFAOYSA-N
XLogP4.82
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.47
LogP ≤ 54.82
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-tri(propan-2-yl)silyloxyaniline?
The IUPAC name of 4-tri(propan-2-yl)silyloxyaniline (CID 86719492) is 4-tri(propan-2-yl)silyloxyaniline.
What is the SMILES notation for 4-tri(propan-2-yl)silyloxyaniline?
The canonical SMILES for 4-tri(propan-2-yl)silyloxyaniline is CC(C)[Si](Oc1ccc(N)cc1)(C(C)C)C(C)C.
What is the InChIKey of 4-tri(propan-2-yl)silyloxyaniline?
The InChIKey is YJGSHNCJISIEOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NOSi/c1-11(2)18(12(3)4,13(5)6)17-15-9-7-14(16)8-10-15/h7-13H,16H2,1-6H3.
What are the key properties of 4-tri(propan-2-yl)silyloxyaniline?
4-tri(propan-2-yl)silyloxyaniline has a molecular weight of 265.47 g/mol, XLogP of 4.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tri(propan-2-yl)silyloxyaniline is sourced from PubChem (CID 86719492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).