[1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane

C15H25N3OSi — CID 3405189

IUPAC[1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane
SMILESCC(C)(C)OC(C)(n1nnc2ccccc21)[Si](C)(C)C
InChIInChI=1S/C15H25N3OSi/c1-14(2,3)19-15(4,20(5,6)7)18-13-11-9-8-10-12(13)16-17-18/h8-11H,1-7H3
InChIKeyHRQTXQBEFCJPFO-UHFFFAOYSA-N
MW291.47 g/mol
LogP3.80
Rot. Bonds3

About [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane

[1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane (PubChem CID 3405189) has the molecular formula C15H25N3OSi and a molecular weight of 291.47 g/mol. Its IUPAC name is [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane.

Molecular Properties

Compound Name[1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane
PubChem CID3405189
Molecular FormulaC15H25N3OSi
Molecular Weight291.47 g/mol
Exact Mass291.18
IUPAC Name[1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane
SMILESCC(C)(C)OC(C)(n1nnc2ccccc21)[Si](C)(C)C
InChIInChI=1S/C15H25N3OSi/c1-14(2,3)19-15(4,20(5,6)7)18-13-11-9-8-10-12(13)16-17-18/h8-11H,1-7H3
InChIKeyHRQTXQBEFCJPFO-UHFFFAOYSA-N
XLogP3.80
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.47
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(benzotriazol-2-yl)propan-2-yl]benzotriazole
CID 4311537
1-(benzotriazol-1-yl)-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
CID 70885057
1-tert-butylbenzotriazole;3-tert-butyltriazolo[4,5-b]pyridine
CID 161246288
2-(benzotriazol-1-yl)-2,2-difluoroethanol
CID 118312748
1-(3-methyl-2-phenylsulfanylbutan-2-yl)benzotriazole
CID 3803457
benzotriazol-1-yl(trimethyl)stannane
CID 165357783
2-(benzotriazol-1-yl)-2-methylpentanoic acid
CID 114993659
2-(benzotriazol-1-yl)-2-ethylbutanoic acid
CID 82152137
methane;1-methoxybenzotriazole
CID 161160564
1-(3,3-dimethylbutan-2-yl)benzotriazole
CID 175055537
tris(benzotriazol-1-yl)-tert-butyl-λ4-sulfane
CID 146336808
CID 68739763
CID 68739763

Frequently Asked Questions

What is the IUPAC name of [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane?
The IUPAC name of [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane (CID 3405189) is [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane.
What is the SMILES notation for [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane?
The canonical SMILES for [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane is CC(C)(C)OC(C)(n1nnc2ccccc21)[Si](C)(C)C.
What is the InChIKey of [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane?
The InChIKey is HRQTXQBEFCJPFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3OSi/c1-14(2,3)19-15(4,20(5,6)7)18-13-11-9-8-10-12(13)16-17-18/h8-11H,1-7H3.
What are the key properties of [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane?
[1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane has a molecular weight of 291.47 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(benzotriazol-1-yl)-1-[(2-methylpropan-2-yl)oxy]ethyl]-trimethylsilane is sourced from PubChem (CID 3405189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).