N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine

C16H25NSi — CID 122229684

IUPACN-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine
SMILESCC(=C=N[Si](C)(C)C(C)(C)C)Cc1ccccc1
InChIInChI=1S/C16H25NSi/c1-14(12-15-10-8-7-9-11-15)13-17-18(5,6)16(2,3)4/h7-11H,12H2,1-6H3
InChIKeyJGZPNMWWRJIBOY-UHFFFAOYSA-N
MW259.47 g/mol
LogP4.85
Rot. Bonds3

About N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine

N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine (PubChem CID 122229684) has the molecular formula C16H25NSi and a molecular weight of 259.47 g/mol. Its IUPAC name is N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine.

Molecular Properties

Compound NameN-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine
PubChem CID122229684
Molecular FormulaC16H25NSi
Molecular Weight259.47 g/mol
Exact Mass259.18
IUPAC NameN-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine
SMILESCC(=C=N[Si](C)(C)C(C)(C)C)Cc1ccccc1
InChIInChI=1S/C16H25NSi/c1-14(12-15-10-8-7-9-11-15)13-17-18(5,6)16(2,3)4/h7-11H,12H2,1-6H3
InChIKeyJGZPNMWWRJIBOY-UHFFFAOYSA-N
XLogP4.85
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.47
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-[tert-butyl(dimethyl)silyl]-2-cyclopentyl-2-phenylethenimine
CID 11277974
[tert-butyl(dimethyl)silyl] 2-phenylacetate
CID 528591
N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine
CID 13179376
tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane
CID 101151962
(3S)-3-[tert-butyl(dimethyl)silyl]oxy-1-phenylbutan-2-one
CID 101209372
(NE)-N-[1-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-2-phenylethylidene]hydroxylamine
CID 59857614
trimethylsilyl (1Z)-2-phenyl-N-propan-2-ylideneethanehydrazonate
CID 101269959
(E)-N-tert-butylsulfanyl-1-phenylpropan-2-imine
CID 130421182
benzene;1-phenylpropan-2-one
CID 21430852
1-phenylpropane-2-thione
CID 19915653
(NE)-N-(2-benzyl-3-methylbut-2-enylidene)hydroxylamine
CID 134240579
trimethyl(3-phenylprop-1-en-2-yl)silane
CID 530293

Frequently Asked Questions

What is the IUPAC name of N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine?
The IUPAC name of N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine (CID 122229684) is N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine.
What is the SMILES notation for N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine?
The canonical SMILES for N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine is CC(=C=N[Si](C)(C)C(C)(C)C)Cc1ccccc1.
What is the InChIKey of N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine?
The InChIKey is JGZPNMWWRJIBOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NSi/c1-14(12-15-10-8-7-9-11-15)13-17-18(5,6)16(2,3)4/h7-11H,12H2,1-6H3.
What are the key properties of N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine?
N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine has a molecular weight of 259.47 g/mol, XLogP of 4.85, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine is sourced from PubChem (CID 122229684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).