(E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine

C23H33NO2Si — CID 13483445

IUPAC(E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine
SMILESCC(C)(C)O/C(=C\N(Cc1ccccc1)Cc1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C23H33NO2Si/c1-23(2,3)25-22(26-27(4,5)6)19-24(17-20-13-9-7-10-14-20)18-21-15-11-8-12-16-21/h7-16,19H,17-18H2,1-6H3/b22-19+
InChIKeyJFHKZQNRSOWLLR-ZBJSNUHESA-N
MW383.61 g/mol
LogP6.15
Rot. Bonds8

About (E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine

(E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine (PubChem CID 13483445) has the molecular formula C23H33NO2Si and a molecular weight of 383.61 g/mol. Its IUPAC name is (E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine.

Molecular Properties

Compound Name(E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine
PubChem CID13483445
Molecular FormulaC23H33NO2Si
Molecular Weight383.61 g/mol
Exact Mass383.23
IUPAC Name(E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine
SMILESCC(C)(C)O/C(=C\N(Cc1ccccc1)Cc1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C23H33NO2Si/c1-23(2,3)25-22(26-27(4,5)6)19-24(17-20-13-9-7-10-14-20)18-21-15-11-8-12-16-21/h7-16,19H,17-18H2,1-6H3/b22-19+
InChIKeyJFHKZQNRSOWLLR-ZBJSNUHESA-N
XLogP6.15
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.61
LogP ≤ 56.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane
CID 71271588
N-[(E)-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenyl]-1,1-diphenylmethanimine
CID 11824747
trimethyl-[(Z)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane
CID 10878232
tert-butyl N-benzyl-N-formylcarbamate
CID 53419906
tert-butyl N-benzyl-N-(3,3-dimethyl-4-oxobutyl)carbamate
CID 146629993
trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-2-phenylbut-1-enoxy]silane
CID 101240315
trimethyl-[(Z)-1-[(2-methylpropan-2-yl)oxy]-2-phenylbut-1-enoxy]silane
CID 101240316
tert-butyl 3-[benzyl(prop-2-enyl)amino]propanoate
CID 102165684
tert-butyl N-[2-[[benzyl(methyl)carbamoyl]amino]ethyl]carbamate
CID 60613829
tert-butyl 2-[benzyl(prop-2-enyl)amino]acetate
CID 134867312
tert-butyl N-benzyl-N-(2-hydroxypropan-2-yl)carbamate
CID 139793857
trimethylsilyl (2S)-2-[[2-[benzyl-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]acetyl]amino]-3-phenylpropanoate
CID 164771640

Frequently Asked Questions

What is the IUPAC name of (E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine?
The IUPAC name of (E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine (CID 13483445) is (E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine.
What is the SMILES notation for (E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine?
The canonical SMILES for (E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine is CC(C)(C)O/C(=C\N(Cc1ccccc1)Cc1ccccc1)O[Si](C)(C)C.
What is the InChIKey of (E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine?
The InChIKey is JFHKZQNRSOWLLR-ZBJSNUHESA-N. The full InChI is InChI=1S/C23H33NO2Si/c1-23(2,3)25-22(26-27(4,5)6)19-24(17-20-13-9-7-10-14-20)18-21-15-11-8-12-16-21/h7-16,19H,17-18H2,1-6H3/b22-19+.
What are the key properties of (E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine?
(E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine has a molecular weight of 383.61 g/mol, XLogP of 6.15, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine is sourced from PubChem (CID 13483445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).