(E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine

C11H25NOSi — CID 125478313

IUPAC(E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine
SMILESCNC/C=C/CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H25NOSi/c1-11(2,3)14(5,6)13-10-8-7-9-12-4/h7-8,12H,9-10H2,1-6H3/b8-7+
InChIKeyCUQGZTKNCMSBAV-BQYQJAHWSA-N
MW215.41 g/mol
LogP2.78
Rot. Bonds5

About (E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine

(E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine (PubChem CID 125478313) has the molecular formula C11H25NOSi and a molecular weight of 215.41 g/mol. Its IUPAC name is (E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine.

Molecular Properties

Compound Name(E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine
PubChem CID125478313
Molecular FormulaC11H25NOSi
Molecular Weight215.41 g/mol
Exact Mass215.17
IUPAC Name(E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine
SMILESCNC/C=C/CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H25NOSi/c1-11(2,3)14(5,6)13-10-8-7-9-12-4/h7-8,12H,9-10H2,1-6H3/b8-7+
InChIKeyCUQGZTKNCMSBAV-BQYQJAHWSA-N
XLogP2.78
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.41
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-(5,5-dimethylhex-2-enoxy)-dimethylsilane
CID 76815810
tert-butyl-[(Z)-5,5-dimethylhex-2-enoxy]-dimethylsilane
CID 58534802
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexa-2,4-dienoxy]-dimethylsilane
CID 123215238
(E)-6-[tert-butyl(dimethyl)silyl]oxyhex-4-enal
CID 19914775
tert-butyl-dimethyl-[(2Z,6E)-6-methylocta-2,6-dienoxy]silane
CID 124629180
tert-butyl-dimethyl-[(Z)-pent-2-en-4-ynoxy]silane
CID 135083715
4-azidobut-2-enoxy-tert-butyl-dimethylsilane
CID 71412857
tert-butyl [(Z)-4-[tert-butyl(dimethyl)silyl]oxybut-2-enyl] carbonate
CID 59981762
tert-butyl-[(Z)-hex-2-en-4-ynoxy]-dimethylsilane
CID 121012872
4-[tert-butyl(dimethyl)silyl]oxybut-2-enoic acid
CID 85272131
(Z)-4-[tert-butyl(dimethyl)silyl]oxybut-2-enoic acid
CID 87108753
tert-butyl-dimethyl-[(E)-5-[(2R)-oxiran-2-yl]pent-2-enoxy]silane
CID 124636126

Frequently Asked Questions

What is the IUPAC name of (E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine?
The IUPAC name of (E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine (CID 125478313) is (E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine.
What is the SMILES notation for (E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine?
The canonical SMILES for (E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine is CNC/C=C/CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of (E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine?
The InChIKey is CUQGZTKNCMSBAV-BQYQJAHWSA-N. The full InChI is InChI=1S/C11H25NOSi/c1-11(2,3)14(5,6)13-10-8-7-9-12-4/h7-8,12H,9-10H2,1-6H3/b8-7+.
What are the key properties of (E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine?
(E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine has a molecular weight of 215.41 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-[tert-butyl(dimethyl)silyl]oxy-N-methylbut-2-en-1-amine is sourced from PubChem (CID 125478313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).