[(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane

C15H24N2OSi — CID 71378419

IUPAC[(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane
SMILESC[C@H](O[Si](C)(C)C(C)(C)C)c1nc2ccccc2[nH]1
InChIInChI=1S/C15H24N2OSi/c1-11(18-19(5,6)15(2,3)4)14-16-12-9-7-8-10-13(12)17-14/h7-11H,1-6H3,(H,16,17)/t11-/m0/s1
InChIKeyIHBOKQSIZIOZTG-NSHDSACASA-N
MW276.46 g/mol
LogP4.65
Rot. Bonds3

About [(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane

[(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane (PubChem CID 71378419) has the molecular formula C15H24N2OSi and a molecular weight of 276.46 g/mol. Its IUPAC name is [(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name[(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane
PubChem CID71378419
Molecular FormulaC15H24N2OSi
Molecular Weight276.46 g/mol
Exact Mass276.17
IUPAC Name[(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane
SMILESC[C@H](O[Si](C)(C)C(C)(C)C)c1nc2ccccc2[nH]1
InChIInChI=1S/C15H24N2OSi/c1-11(18-19(5,6)15(2,3)4)14-16-12-9-7-8-10-13(12)17-14/h7-11H,1-6H3,(H,16,17)/t11-/m0/s1
InChIKeyIHBOKQSIZIOZTG-NSHDSACASA-N
XLogP4.65
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.46
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-propan-2-yl-1H-benzimidazole
CID 22121
(1S)-1-(1H-benzimidazol-2-yl)ethanol
CID 139074850
2-[1-(3-chlorophenoxy)ethyl]-1H-benzimidazole
CID 55052996
2-(2-methyl-1-phenylpropyl)-1H-benzimidazole
CID 146180752
4-[1-(1H-benzimidazol-2-yl)ethoxy]benzoic acid
CID 69478417
2-[1-(4-chloro-2-methylphenoxy)ethyl]-1H-benzimidazole
CID 139695635
(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropan-1-amine;dihydrochloride
CID 112756298
1-(1H-benzimidazol-2-yl)ethyl 3,4-dichlorobenzoate
CID 154833747
N-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]-2,2-dimethylpropanamide
CID 751239
2-(1-ethoxypropan-2-yl)-1H-benzimidazole
CID 20681263
1-(1H-benzimidazol-2-yl)ethyl cyclohexanecarboxylate
CID 3152016
[(1R)-1-(1H-benzimidazol-2-yl)ethyl] cyclohexanecarboxylate
CID 1079144

Frequently Asked Questions

What is the IUPAC name of [(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane?
The IUPAC name of [(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane (CID 71378419) is [(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane.
What is the SMILES notation for [(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane?
The canonical SMILES for [(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane is C[C@H](O[Si](C)(C)C(C)(C)C)c1nc2ccccc2[nH]1.
What is the InChIKey of [(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane?
The InChIKey is IHBOKQSIZIOZTG-NSHDSACASA-N. The full InChI is InChI=1S/C15H24N2OSi/c1-11(18-19(5,6)15(2,3)4)14-16-12-9-7-8-10-13(12)17-14/h7-11H,1-6H3,(H,16,17)/t11-/m0/s1.
What are the key properties of [(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane?
[(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane has a molecular weight of 276.46 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S)-1-(1H-benzimidazol-2-yl)ethoxy]-tert-butyl-dimethylsilane is sourced from PubChem (CID 71378419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).