1-propan-2-ylimino-2-trimethylsilylbutan-2-ol

C10H23NOSi — CID 140784647

IUPAC1-propan-2-ylimino-2-trimethylsilylbutan-2-ol
SMILESCCC(O)(/C=N/C(C)C)[Si](C)(C)C
InChIInChI=1S/C10H23NOSi/c1-7-10(12,13(4,5)6)8-11-9(2)3/h8-9,12H,7H2,1-6H3/b11-8+
InChIKeyXHORKKOJKSLFPH-DHZHZOJOSA-N
MW201.39 g/mol
LogP2.48
Rot. Bonds4

About 1-propan-2-ylimino-2-trimethylsilylbutan-2-ol

1-propan-2-ylimino-2-trimethylsilylbutan-2-ol (PubChem CID 140784647) has the molecular formula C10H23NOSi and a molecular weight of 201.39 g/mol. Its IUPAC name is 1-propan-2-ylimino-2-trimethylsilylbutan-2-ol.

Molecular Properties

Compound Name1-propan-2-ylimino-2-trimethylsilylbutan-2-ol
PubChem CID140784647
Molecular FormulaC10H23NOSi
Molecular Weight201.39 g/mol
Exact Mass201.15
IUPAC Name1-propan-2-ylimino-2-trimethylsilylbutan-2-ol
SMILESCCC(O)(/C=N/C(C)C)[Si](C)(C)C
InChIInChI=1S/C10H23NOSi/c1-7-10(12,13(4,5)6)8-11-9(2)3/h8-9,12H,7H2,1-6H3/b11-8+
InChIKeyXHORKKOJKSLFPH-DHZHZOJOSA-N
XLogP2.48
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.39
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-propan-2-ylimino-2-trimethylsilylbutan-2-ol?
The IUPAC name of 1-propan-2-ylimino-2-trimethylsilylbutan-2-ol (CID 140784647) is 1-propan-2-ylimino-2-trimethylsilylbutan-2-ol.
What is the SMILES notation for 1-propan-2-ylimino-2-trimethylsilylbutan-2-ol?
The canonical SMILES for 1-propan-2-ylimino-2-trimethylsilylbutan-2-ol is CCC(O)(/C=N/C(C)C)[Si](C)(C)C.
What is the InChIKey of 1-propan-2-ylimino-2-trimethylsilylbutan-2-ol?
The InChIKey is XHORKKOJKSLFPH-DHZHZOJOSA-N. The full InChI is InChI=1S/C10H23NOSi/c1-7-10(12,13(4,5)6)8-11-9(2)3/h8-9,12H,7H2,1-6H3/b11-8+.
What are the key properties of 1-propan-2-ylimino-2-trimethylsilylbutan-2-ol?
1-propan-2-ylimino-2-trimethylsilylbutan-2-ol has a molecular weight of 201.39 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-ylimino-2-trimethylsilylbutan-2-ol is sourced from PubChem (CID 140784647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).