2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane

C16H24BrN3OSi — CID 140796375

IUPAC2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane
SMILESCc1nc(-c2cc(Br)ccn2)n(COCC[Si](C)(C)C)c1C
InChIInChI=1S/C16H24BrN3OSi/c1-12-13(2)20(11-21-8-9-22(3,4)5)16(19-12)15-10-14(17)6-7-18-15/h6-7,10H,8-9,11H2,1-5H3
InChIKeyAGGCUOZTBJIBGA-UHFFFAOYSA-N
MW382.38 g/mol
LogP4.64
Rot. Bonds6

About 2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane

2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane (PubChem CID 140796375) has the molecular formula C16H24BrN3OSi and a molecular weight of 382.38 g/mol. Its IUPAC name is 2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane
PubChem CID140796375
Molecular FormulaC16H24BrN3OSi
Molecular Weight382.38 g/mol
Exact Mass381.09
IUPAC Name2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane
SMILESCc1nc(-c2cc(Br)ccn2)n(COCC[Si](C)(C)C)c1C
InChIInChI=1S/C16H24BrN3OSi/c1-12-13(2)20(11-21-8-9-22(3,4)5)16(19-12)15-10-14(17)6-7-18-15/h6-7,10H,8-9,11H2,1-5H3
InChIKeyAGGCUOZTBJIBGA-UHFFFAOYSA-N
XLogP4.64
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.38
LogP ≤ 54.64
H-Bond Donors ≤ 50
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

2-[2-[4-iodo-5-methyl-1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]-4-pyridinyl]-3H-isoindol-1-one
CID 175809964
2-[(5-bromo-2-methylimidazol-1-yl)methoxy]ethyl-trimethylsilane
CID 125480758
2-[[4-bromo-5-(2-chloropyrimidin-4-yl)-2-phenylimidazol-1-yl]methoxy]ethyl-trimethylsilane
CID 59137278
2-[[5-bromo-2-(2-methylpyrazol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane
CID 174083889
6-bromo-8-methyl-2-thieno[2,3-c]pyridin-5-yl-3-(2-trimethylsilylethoxymethyl)quinazolin-4-one
CID 153396896
2-[[4-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-2-yl]methoxy]-N,N-dimethylethanamine
CID 142547745
2-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]pyridine-4-carboxylic acid
CID 154665027
trimethyl-[2-[[4-methyl-2-[4-(1H-pyrazol-4-yl)-2-pyridinyl]imidazol-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[5-methyl-2-[4-(1H-pyrazol-4-yl)-2-pyridinyl]imidazol-1-yl]methoxy]ethyl]silane
CID 161385712
2-[(2-chloro-6-methylpyrrolo[3,2-d]pyrimidin-5-yl)methoxy]ethyl-trimethylsilane
CID 164881290
2-[(5-bromo-7-methylindazol-1-yl)methoxy]ethyl-trimethylsilane
CID 58181208
2-[[6-bromo-5-(4-methylsulfonylphenoxy)-2-pyridin-2-ylbenzimidazol-1-yl]methoxy]ethyl-trimethylsilane
CID 57433530
6-bromo-8-ethyl-2-thieno[2,3-c]pyridin-5-yl-3-(2-trimethylsilylethoxymethyl)quinazolin-4-one
CID 153396776

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane (CID 140796375) is 2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane is Cc1nc(-c2cc(Br)ccn2)n(COCC[Si](C)(C)C)c1C.
What is the InChIKey of 2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane?
The InChIKey is AGGCUOZTBJIBGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24BrN3OSi/c1-12-13(2)20(11-21-8-9-22(3,4)5)16(19-12)15-10-14(17)6-7-18-15/h6-7,10H,8-9,11H2,1-5H3.
What are the key properties of 2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane?
2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane has a molecular weight of 382.38 g/mol, XLogP of 4.64, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-bromo-2-pyridinyl)-4,5-dimethylimidazol-1-yl]methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 140796375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).