(E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine

C25H33NSi — CID 102205549

IUPAC(E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine
SMILESCc1cccc(C)c1/N=C/C(=C/[Si](C)(C)c1ccccc1)C1CCCCC1
InChIInChI=1S/C25H33NSi/c1-20-12-11-13-21(2)25(20)26-18-23(22-14-7-5-8-15-22)19-27(3,4)24-16-9-6-10-17-24/h6,9-13,16-19,22H,5,7-8,14-15H2,1-4H3/b23-19-,26-18+
InChIKeyXGHNEKMYXQNVMX-UPDZRMIOSA-N
MW375.63 g/mol
LogP6.67
Rot. Bonds5

About (E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine

(E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine (PubChem CID 102205549) has the molecular formula C25H33NSi and a molecular weight of 375.63 g/mol. Its IUPAC name is (E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine.

Molecular Properties

Compound Name(E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine
PubChem CID102205549
Molecular FormulaC25H33NSi
Molecular Weight375.63 g/mol
Exact Mass375.24
IUPAC Name(E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine
SMILESCc1cccc(C)c1/N=C/C(=C/[Si](C)(C)c1ccccc1)C1CCCCC1
InChIInChI=1S/C25H33NSi/c1-20-12-11-13-21(2)25(20)26-18-23(22-14-7-5-8-15-22)19-27(3,4)24-16-9-6-10-17-24/h6,9-13,16-19,22H,5,7-8,14-15H2,1-4H3/b23-19-,26-18+
InChIKeyXGHNEKMYXQNVMX-UPDZRMIOSA-N
XLogP6.67
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.63
LogP ≤ 56.67
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

Benzenamine, 2,6-dimethyl-N-(phenylmethylene)-
CID 137822
N1-[(Z)-2[(2,6-dimethylphenyl)-imino]-ethyliden]-2,6-dimethylanilin
CID 583301
N,N'-Bis(2,6-diisopropylphenyl)ethanediimine
CID 630473
(E)-N-[2,6-Di(propan-2-yl)phenyl]-1-(2-fluorophenyl)methanimine
CID 71365591
2,6-Dimethyl-N-(diphenylmethylene)benzenamine
CID 11011559
N-(2,6-diethylphenyl)-1-(2-fluorophenyl)methanimine
CID 91585635
N-[2,6-di(propan-2-yl)phenyl]-1-[2-(4-fluorophenyl)-6-methylphenyl]methanimine
CID 135004092
N-Benzylidene-2,6-diisopropylaniline
CID 1284732
1-(2-diphenylphosphanylphenyl)-N-[2,6-di(propan-2-yl)phenyl]methanimine
CID 10876115
N-(2,6-dimethylphenyl)-2-phenylethanimine
CID 11251074
N-benzylidene-N-mesitylamine
CID 12412492
1-N,2-N-bis(2,6-dimethylphenyl)propane-1,2-diimine
CID 12743350

Frequently Asked Questions

What is the IUPAC name of (E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine?
The IUPAC name of (E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine (CID 102205549) is (E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine.
What is the SMILES notation for (E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine?
The canonical SMILES for (E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine is Cc1cccc(C)c1/N=C/C(=C/[Si](C)(C)c1ccccc1)C1CCCCC1.
What is the InChIKey of (E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine?
The InChIKey is XGHNEKMYXQNVMX-UPDZRMIOSA-N. The full InChI is InChI=1S/C25H33NSi/c1-20-12-11-13-21(2)25(20)26-18-23(22-14-7-5-8-15-22)19-27(3,4)24-16-9-6-10-17-24/h6,9-13,16-19,22H,5,7-8,14-15H2,1-4H3/b23-19-,26-18+.
What are the key properties of (E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine?
(E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine has a molecular weight of 375.63 g/mol, XLogP of 6.67, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-cyclohexyl-N-(2,6-dimethylphenyl)-3-[dimethyl(phenyl)silyl]prop-2-en-1-imine is sourced from PubChem (CID 102205549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).