1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine

C16H28N2Si2 — CID 10573468

IUPAC1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine
SMILES[H]/N=C(\CCCN1[Si](C)(C)CC[Si]1(C)C)c1ccccc1
InChIInChI=1S/C16H28N2Si2/c1-19(2)13-14-20(3,4)18(19)12-8-11-16(17)15-9-6-5-7-10-15/h5-7,9-10,17H,8,11-14H2,1-4H3/b17-16+
InChIKeyLBZFIVSRYDCGIG-WUKNDPDISA-N
MW304.59 g/mol
LogP4.56
Rot. Bonds5

About 1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine

1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine (PubChem CID 10573468) has the molecular formula C16H28N2Si2 and a molecular weight of 304.59 g/mol. Its IUPAC name is 1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine.

Molecular Properties

Compound Name1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine
PubChem CID10573468
Molecular FormulaC16H28N2Si2
Molecular Weight304.59 g/mol
Exact Mass304.18
IUPAC Name1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine
SMILES[H]/N=C(\CCCN1[Si](C)(C)CC[Si]1(C)C)c1ccccc1
InChIInChI=1S/C16H28N2Si2/c1-19(2)13-14-20(3,4)18(19)12-8-11-16(17)15-9-6-5-7-10-15/h5-7,9-10,17H,8,11-14H2,1-4H3/b17-16+
InChIKeyLBZFIVSRYDCGIG-WUKNDPDISA-N
XLogP4.56
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.59
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine?
The IUPAC name of 1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine (CID 10573468) is 1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine.
What is the SMILES notation for 1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine?
The canonical SMILES for 1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine is [H]/N=C(\CCCN1[Si](C)(C)CC[Si]1(C)C)c1ccccc1.
What is the InChIKey of 1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine?
The InChIKey is LBZFIVSRYDCGIG-WUKNDPDISA-N. The full InChI is InChI=1S/C16H28N2Si2/c1-19(2)13-14-20(3,4)18(19)12-8-11-16(17)15-9-6-5-7-10-15/h5-7,9-10,17H,8,11-14H2,1-4H3/b17-16+.
What are the key properties of 1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine?
1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine has a molecular weight of 304.59 g/mol, XLogP of 4.56, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)butan-1-imine is sourced from PubChem (CID 10573468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).