1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane

C13H26N2OSi — CID 54439725

IUPAC1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane
SMILESCCCCc1ncc(COC(C)[Si](C)(C)C)[nH]1
InChIInChI=1S/C13H26N2OSi/c1-6-7-8-13-14-9-12(15-13)10-16-11(2)17(3,4)5/h9,11H,6-8,10H2,1-5H3,(H,14,15)
InChIKeyWNFXFVLIMVTYRL-UHFFFAOYSA-N
MW254.45 g/mol
LogP3.53
Rot. Bonds7

About 1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane

1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane (PubChem CID 54439725) has the molecular formula C13H26N2OSi and a molecular weight of 254.45 g/mol. Its IUPAC name is 1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane
PubChem CID54439725
Molecular FormulaC13H26N2OSi
Molecular Weight254.45 g/mol
Exact Mass254.18
IUPAC Name1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane
SMILESCCCCc1ncc(COC(C)[Si](C)(C)C)[nH]1
InChIInChI=1S/C13H26N2OSi/c1-6-7-8-13-14-9-12(15-13)10-16-11(2)17(3,4)5/h9,11H,6-8,10H2,1-5H3,(H,14,15)
InChIKeyWNFXFVLIMVTYRL-UHFFFAOYSA-N
XLogP3.53
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.45
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane?
The IUPAC name of 1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane (CID 54439725) is 1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane?
The canonical SMILES for 1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane is CCCCc1ncc(COC(C)[Si](C)(C)C)[nH]1.
What is the InChIKey of 1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane?
The InChIKey is WNFXFVLIMVTYRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2OSi/c1-6-7-8-13-14-9-12(15-13)10-16-11(2)17(3,4)5/h9,11H,6-8,10H2,1-5H3,(H,14,15).
What are the key properties of 1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane?
1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane has a molecular weight of 254.45 g/mol, XLogP of 3.53, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-butyl-1H-imidazol-5-yl)methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 54439725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).