1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol

C15H24N2OSi — CID 174657281

IUPAC1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol
SMILESCN1CN(C(C)(O)[Si](C)(C)C)C=C1c1ccccc1
InChIInChI=1S/C15H24N2OSi/c1-15(18,19(3,4)5)17-11-14(16(2)12-17)13-9-7-6-8-10-13/h6-11,18H,12H2,1-5H3
InChIKeyMCBAXPQUUCNSOL-UHFFFAOYSA-N
MW276.46 g/mol
LogP2.78
Rot. Bonds3

About 1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol

1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol (PubChem CID 174657281) has the molecular formula C15H24N2OSi and a molecular weight of 276.46 g/mol. Its IUPAC name is 1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol.

Molecular Properties

Compound Name1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol
PubChem CID174657281
Molecular FormulaC15H24N2OSi
Molecular Weight276.46 g/mol
Exact Mass276.17
IUPAC Name1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol
SMILESCN1CN(C(C)(O)[Si](C)(C)C)C=C1c1ccccc1
InChIInChI=1S/C15H24N2OSi/c1-15(18,19(3,4)5)17-11-14(16(2)12-17)13-9-7-6-8-10-13/h6-11,18H,12H2,1-5H3
InChIKeyMCBAXPQUUCNSOL-UHFFFAOYSA-N
XLogP2.78
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.46
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol?
The IUPAC name of 1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol (CID 174657281) is 1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol.
What is the SMILES notation for 1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol?
The canonical SMILES for 1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol is CN1CN(C(C)(O)[Si](C)(C)C)C=C1c1ccccc1.
What is the InChIKey of 1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol?
The InChIKey is MCBAXPQUUCNSOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OSi/c1-15(18,19(3,4)5)17-11-14(16(2)12-17)13-9-7-6-8-10-13/h6-11,18H,12H2,1-5H3.
What are the key properties of 1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol?
1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol has a molecular weight of 276.46 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-4-phenyl-2H-imidazol-1-yl)-1-trimethylsilylethanol is sourced from PubChem (CID 174657281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).