tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane

C11H23N3OSi — CID 69188963

IUPACtert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane
SMILESCCn1cnc(CO[Si](C)(C)C(C)(C)C)n1
InChIInChI=1S/C11H23N3OSi/c1-7-14-9-12-10(13-14)8-15-16(5,6)11(2,3)4/h9H,7-8H2,1-6H3
InChIKeyDENFLBKYWXKUQE-UHFFFAOYSA-N
MW241.41 g/mol
LogP2.82
Rot. Bonds4

About tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane

tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane (PubChem CID 69188963) has the molecular formula C11H23N3OSi and a molecular weight of 241.41 g/mol. Its IUPAC name is tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane
PubChem CID69188963
Molecular FormulaC11H23N3OSi
Molecular Weight241.41 g/mol
Exact Mass241.16
IUPAC Nametert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane
SMILESCCn1cnc(CO[Si](C)(C)C(C)(C)C)n1
InChIInChI=1S/C11H23N3OSi/c1-7-14-9-12-10(13-14)8-15-16(5,6)11(2,3)4/h9H,7-8H2,1-6H3
InChIKeyDENFLBKYWXKUQE-UHFFFAOYSA-N
XLogP2.82
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.41
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethyl-λ4-sulfane
CID 143698092
tert-butyl-[(2-chloropyrimidin-5-yl)methoxy]-dimethylsilane
CID 140802501
4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-methylpyrazole-3-carbaldehyde
CID 175822423
2-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-methylpyrazol-1-yl]acetic acid
CID 174156217
tert-butyl-[[5-(2-chloropyrimidin-4-yl)-1-methyl-1,2,4-triazol-3-yl]methoxy]-dimethylsilane
CID 167435892
tert-butyl-dimethyl-(1H-1,2,4-triazol-5-ylmethoxy)silane
CID 10242322
3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]imidazol-1-yl]propan-1-amine
CID 20728226
tert-butyl-dimethyl-[(4-methylphenyl)methoxy]silane
CID 21304531
tert-butyl-[(4-tert-butylphenyl)methoxy]-dimethylsilane
CID 101140446
6-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-4-amine
CID 21059983
[4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane
CID 10757711
5-[[tert-butyl(dimethyl)silyl]oxymethyl]benzene-1,3-diamine
CID 71429023

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane (CID 69188963) is tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane is CCn1cnc(CO[Si](C)(C)C(C)(C)C)n1.
What is the InChIKey of tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane?
The InChIKey is DENFLBKYWXKUQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3OSi/c1-7-14-9-12-10(13-14)8-15-16(5,6)11(2,3)4/h9H,7-8H2,1-6H3.
What are the key properties of tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane?
tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane has a molecular weight of 241.41 g/mol, XLogP of 2.82, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(1-ethyl-1,2,4-triazol-3-yl)methoxy]-dimethylsilane is sourced from PubChem (CID 69188963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).