(E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine

C12H27NSi — CID 134925367

IUPAC(E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine
SMILESCCC/C=N/[Si](C)(C)C(C)(C)C(C)C
InChIInChI=1S/C12H27NSi/c1-8-9-10-13-14(6,7)12(4,5)11(2)3/h10-11H,8-9H2,1-7H3/b13-10+
InChIKeyAZIARFUCQNOQJU-JLHYYAGUSA-N
MW213.44 g/mol
LogP4.50
Rot. Bonds5

About (E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine

(E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine (PubChem CID 134925367) has the molecular formula C12H27NSi and a molecular weight of 213.44 g/mol. Its IUPAC name is (E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine.

Molecular Properties

Compound Name(E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine
PubChem CID134925367
Molecular FormulaC12H27NSi
Molecular Weight213.44 g/mol
Exact Mass213.19
IUPAC Name(E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine
SMILESCCC/C=N/[Si](C)(C)C(C)(C)C(C)C
InChIInChI=1S/C12H27NSi/c1-8-9-10-13-14(6,7)12(4,5)11(2)3/h10-11H,8-9H2,1-7H3/b13-10+
InChIKeyAZIARFUCQNOQJU-JLHYYAGUSA-N
XLogP4.50
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.44
LogP ≤ 54.50
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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Frequently Asked Questions

What is the IUPAC name of (E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine?
The IUPAC name of (E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine (CID 134925367) is (E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine.
What is the SMILES notation for (E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine?
The canonical SMILES for (E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine is CCC/C=N/[Si](C)(C)C(C)(C)C(C)C.
What is the InChIKey of (E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine?
The InChIKey is AZIARFUCQNOQJU-JLHYYAGUSA-N. The full InChI is InChI=1S/C12H27NSi/c1-8-9-10-13-14(6,7)12(4,5)11(2)3/h10-11H,8-9H2,1-7H3/b13-10+.
What are the key properties of (E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine?
(E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine has a molecular weight of 213.44 g/mol, XLogP of 4.50, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[2,3-dimethylbutan-2-yl(dimethyl)silyl]butan-1-imine is sourced from PubChem (CID 134925367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).