1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine

C15H21NSi — CID 13434252

IUPAC1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine
SMILESC[Si](C)(C)CC#CCC/N=C/c1ccccc1
InChIInChI=1S/C15H21NSi/c1-17(2,3)13-9-5-8-12-16-14-15-10-6-4-7-11-15/h4,6-7,10-11,14H,8,12-13H2,1-3H3/b16-14+
InChIKeyFPSOHJXLVWXMGL-JQIJEIRASA-N
MW243.43 g/mol
LogP3.84
Rot. Bonds4

About 1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine

1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine (PubChem CID 13434252) has the molecular formula C15H21NSi and a molecular weight of 243.43 g/mol. Its IUPAC name is 1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine.

Molecular Properties

Compound Name1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine
PubChem CID13434252
Molecular FormulaC15H21NSi
Molecular Weight243.43 g/mol
Exact Mass243.14
IUPAC Name1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine
SMILESC[Si](C)(C)CC#CCC/N=C/c1ccccc1
InChIInChI=1S/C15H21NSi/c1-17(2,3)13-9-5-8-12-16-14-15-10-6-4-7-11-15/h4,6-7,10-11,14H,8,12-13H2,1-3H3/b16-14+
InChIKeyFPSOHJXLVWXMGL-JQIJEIRASA-N
XLogP3.84
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.43
LogP ≤ 53.84
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': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine?
The IUPAC name of 1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine (CID 13434252) is 1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine.
What is the SMILES notation for 1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine?
The canonical SMILES for 1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine is C[Si](C)(C)CC#CCC/N=C/c1ccccc1.
What is the InChIKey of 1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine?
The InChIKey is FPSOHJXLVWXMGL-JQIJEIRASA-N. The full InChI is InChI=1S/C15H21NSi/c1-17(2,3)13-9-5-8-12-16-14-15-10-6-4-7-11-15/h4,6-7,10-11,14H,8,12-13H2,1-3H3/b16-14+.
What are the key properties of 1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine?
1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine has a molecular weight of 243.43 g/mol, XLogP of 3.84, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(5-trimethylsilylpent-3-ynyl)methanimine is sourced from PubChem (CID 13434252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).