2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile

C20H24N2Si2 — CID 134933045

IUPAC2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile
SMILESC/C(=C/N1[Si](C)(C)c2ccccc2[Si]1(C)C)c1ccccc1C#N
InChIInChI=1S/C20H24N2Si2/c1-16(18-11-7-6-10-17(18)14-21)15-22-23(2,3)19-12-8-9-13-20(19)24(22,4)5/h6-13,15H,1-5H3/b16-15-
InChIKeyDKRXUPCMZJETAY-NXVVXOECSA-N
MW348.60 g/mol
LogP3.76
Rot. Bonds2

About 2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile

2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile (PubChem CID 134933045) has the molecular formula C20H24N2Si2 and a molecular weight of 348.60 g/mol. Its IUPAC name is 2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile.

Molecular Properties

Compound Name2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile
PubChem CID134933045
Molecular FormulaC20H24N2Si2
Molecular Weight348.60 g/mol
Exact Mass348.15
IUPAC Name2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile
SMILESC/C(=C/N1[Si](C)(C)c2ccccc2[Si]1(C)C)c1ccccc1C#N
InChIInChI=1S/C20H24N2Si2/c1-16(18-11-7-6-10-17(18)14-21)15-22-23(2,3)19-12-8-9-13-20(19)24(22,4)5/h6-13,15H,1-5H3/b16-15-
InChIKeyDKRXUPCMZJETAY-NXVVXOECSA-N
XLogP3.76
TPSA27.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.60
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(E)-2-phenyl-1-triethylsilylethenyl]benzonitrile
CID 11616724
1,1,3,3-tetramethyl-2-[(E)-2-phenylethenyl]-2,1,3-benzazadisilole
CID 12736307
1,1,3,3-tetramethyl-2-[(Z)-3-phenylprop-1-enyl]-2,1,3-benzazadisilole
CID 134932623
(Z)-5-methyl-6-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)hex-5-enenitrile
CID 134932625
1,1,3,3-tetramethyl-2-[(Z)-2-phenylprop-1-enyl]-2,1,3-benzazadisilole
CID 134932737
1,1,3,3-tetramethyl-2-[(Z)-2-methyl-3-phenylprop-1-enyl]-2,1,3-benzazadisilole
CID 134933436
3-[2-[(2,3-Dicyanophenyl)-dimethylsilyl]ethyl-dimethylsilyl]benzene-1,2-dicarbonitrile
CID 135034049
2-[(E)-2-[dimethyl(phenyl)silyl]hex-1-enyl]benzonitrile
CID 135062431
2-[(E)-1-[dimethyl(phenyl)silyl]hex-1-enyl]benzonitrile
CID 135062611
2-[(E)-2-[dimethyl(phenyl)silyl]pent-1-enyl]benzonitrile
CID 135062612
2-[(E)-1-[dimethyl(phenyl)silyl]pent-1-enyl]benzonitrile
CID 135062806
4-[Dimethyl-[(2-methylphenyl)methyl]silyl]benzonitrile
CID 173322373

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile?
The IUPAC name of 2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile (CID 134933045) is 2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile.
What is the SMILES notation for 2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile?
The canonical SMILES for 2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile is C/C(=C/N1[Si](C)(C)c2ccccc2[Si]1(C)C)c1ccccc1C#N.
What is the InChIKey of 2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile?
The InChIKey is DKRXUPCMZJETAY-NXVVXOECSA-N. The full InChI is InChI=1S/C20H24N2Si2/c1-16(18-11-7-6-10-17(18)14-21)15-22-23(2,3)19-12-8-9-13-20(19)24(22,4)5/h6-13,15H,1-5H3/b16-15-.
What are the key properties of 2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile?
2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile has a molecular weight of 348.60 g/mol, XLogP of 3.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-1-(1,1,3,3-tetramethyl-2,1,3-benzazadisilol-2-yl)prop-1-en-2-yl]benzonitrile is sourced from PubChem (CID 134933045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).