2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine

C28H57NSi2 — CID 140568847

IUPAC2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine
SMILESC/C=C/C[Si](C/C=N/CCCCCC[Si](C/C=C/C)(CCC)CCC)(CCC)CCC
InChIInChI=1S/C28H57NSi2/c1-7-13-25-30(21-9-3,22-10-4)27-18-16-15-17-19-29-20-28-31(23-11-5,24-12-6)26-14-8-2/h7-8,13-14,20H,9-12,15-19,21-28H2,1-6H3/b13-7+,14-8+,29-20+
InChIKeyLJTZEEKESNWRCT-SMCHKILHSA-N
MW463.94 g/mol
LogP10.31
Rot. Bonds21

About 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine

2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine (PubChem CID 140568847) has the molecular formula C28H57NSi2 and a molecular weight of 463.94 g/mol. Its IUPAC name is 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine.

Molecular Properties

Compound Name2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine
PubChem CID140568847
Molecular FormulaC28H57NSi2
Molecular Weight463.94 g/mol
Exact Mass463.40
IUPAC Name2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine
SMILESC/C=C/C[Si](C/C=N/CCCCCC[Si](C/C=C/C)(CCC)CCC)(CCC)CCC
InChIInChI=1S/C28H57NSi2/c1-7-13-25-30(21-9-3,22-10-4)27-18-16-15-17-19-29-20-28-31(23-11-5,24-12-6)26-14-8-2/h7-8,13-14,20H,9-12,15-19,21-28H2,1-6H3/b13-7+,14-8+,29-20+
InChIKeyLJTZEEKESNWRCT-SMCHKILHSA-N
XLogP10.31
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds21
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.94
LogP ≤ 510.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine with MolForge

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Related Compounds

2-[prop-1-en-2-yl(dipropyl)silyl]-N-[6-[prop-1-en-2-yl(dipropyl)silyl]hexyl]ethanimine
CID 140569166
N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine
CID 123304085
but-2-enyl-hexyl-dimethylsilane
CID 162729066
3-[dimethyl(prop-1-enyl)silyl]-N-hexylpropan-1-imine
CID 173072145
[(E)-oct-2-enyl]-tripropylsilane
CID 102146512
N-pentacosylhexacosan-1-imine
CID 21412184
N-hexacosylheptacosan-1-imine
CID 88829034
N,N'-didecylpentane-1,5-diimine
CID 118371796
N-tetradecyltridecan-1-imine
CID 175147598
N-hexyldecan-1-imine
CID 174719675
(E)-N-octylbut-2-en-1-imine
CID 167240064
N-dodecyl-3-[ethenyl(dimethyl)silyl]propan-1-imine
CID 87397255

Frequently Asked Questions

What is the IUPAC name of 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine?
The IUPAC name of 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine (CID 140568847) is 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine.
What is the SMILES notation for 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine?
The canonical SMILES for 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine is C/C=C/C[Si](C/C=N/CCCCCC[Si](C/C=C/C)(CCC)CCC)(CCC)CCC.
What is the InChIKey of 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine?
The InChIKey is LJTZEEKESNWRCT-SMCHKILHSA-N. The full InChI is InChI=1S/C28H57NSi2/c1-7-13-25-30(21-9-3,22-10-4)27-18-16-15-17-19-29-20-28-31(23-11-5,24-12-6)26-14-8-2/h7-8,13-14,20H,9-12,15-19,21-28H2,1-6H3/b13-7+,14-8+,29-20+.
What are the key properties of 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine?
2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine has a molecular weight of 463.94 g/mol, XLogP of 10.31, 21 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(E)-but-2-enyl]-dipropylsilyl]-N-[6-[[(E)-but-2-enyl]-dipropylsilyl]hexyl]ethanimine is sourced from PubChem (CID 140568847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).