5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane

C12H20Br2N4OSi — CID 161078247

IUPAC5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane
SMILESBrc1cnc[nH]1.C[Si](C)(C)CCOCn1cnc(Br)c1
InChIInChI=1S/C9H17BrN2OSi.C3H3BrN2/c1-14(2,3)5-4-13-8-12-6-9(10)11-7-12;4-3-1-5-2-6-3/h6-7H,4-5,8H2,1-3H3;1-2H,(H,5,6)
InChIKeyUFOKOAUYYNEDGG-UHFFFAOYSA-N
MW424.21 g/mol
LogP4.13
Rot. Bonds5

About 5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane

5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane (PubChem CID 161078247) has the molecular formula C12H20Br2N4OSi and a molecular weight of 424.21 g/mol. Its IUPAC name is 5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane
PubChem CID161078247
Molecular FormulaC12H20Br2N4OSi
Molecular Weight424.21 g/mol
Exact Mass421.98
IUPAC Name5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane
SMILESBrc1cnc[nH]1.C[Si](C)(C)CCOCn1cnc(Br)c1
InChIInChI=1S/C9H17BrN2OSi.C3H3BrN2/c1-14(2,3)5-4-13-8-12-6-9(10)11-7-12;4-3-1-5-2-6-3/h6-7H,4-5,8H2,1-3H3;1-2H,(H,5,6)
InChIKeyUFOKOAUYYNEDGG-UHFFFAOYSA-N
XLogP4.13
TPSA55.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.21
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(2-trimethylsilylethoxymethyl)imidazol-4-amine
CID 58367438
2-[(4-butylimidazol-1-yl)methoxy]ethyl-trimethylsilane
CID 71485604
2-[(4-bromotriazol-2-yl)methoxy]ethyl-trimethylsilane
CID 153333736
trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane
CID 141189277
(4S,5S)-5-methyl-4-[1-(2-trimethylsilylethoxymethyl)imidazol-4-yl]pyrrolidin-2-one
CID 10357175
(4S,5R)-5-methyl-4-[1-(2-trimethylsilylethoxymethyl)imidazol-4-yl]pyrrolidin-2-one
CID 10469798
2-[[4-(2-bromo-4-chloro-5-methoxyphenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane
CID 169030760
2-(imidazol-1-ylmethoxy)ethyl-trimethylsilane
CID 11052605
2-[(4-bromo-5-cyclopropylimidazol-1-yl)methoxy]ethyl-trimethylsilane;2-[(5-bromo-4-cyclopropylimidazol-1-yl)methoxy]ethyl-trimethylsilane;2-[(4-cyclopropylimidazol-1-yl)methoxy]ethyl-trimethylsilane;2-[(5-cyclopropylimidazol-1-yl)methoxy]ethyl-trimethylsilane
CID 167576208
2-[(5-bromoimidazo[4,5-b]pyrazin-3-yl)methoxy]ethyl-trimethylsilane
CID 131742099
CID 162110243
CID 162110243
2-[(5-bromo-2-methylimidazol-1-yl)methoxy]ethyl-trimethylsilane
CID 125480758

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane?
The IUPAC name of 5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane (CID 161078247) is 5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane?
The canonical SMILES for 5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane is Brc1cnc[nH]1.C[Si](C)(C)CCOCn1cnc(Br)c1.
What is the InChIKey of 5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane?
The InChIKey is UFOKOAUYYNEDGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17BrN2OSi.C3H3BrN2/c1-14(2,3)5-4-13-8-12-6-9(10)11-7-12;4-3-1-5-2-6-3/h6-7H,4-5,8H2,1-3H3;1-2H,(H,5,6).
What are the key properties of 5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane?
5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane has a molecular weight of 424.21 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 161078247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).