dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium

C14H20NSi+ — CID 15470829

IUPACdimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium
SMILESC[N+](C)=C(C#C[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C14H20NSi/c1-15(2)14(11-12-16(3,4)5)13-9-7-6-8-10-13/h6-10H,1-5H3/q+1
InChIKeyFSMLRKQANKQYKT-UHFFFAOYSA-N
MW230.41 g/mol
LogP2.63
Rot. Bonds1

About dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium

dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium (PubChem CID 15470829) has the molecular formula C14H20NSi+ and a molecular weight of 230.41 g/mol. Its IUPAC name is dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium.

Molecular Properties

Compound Namedimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium
PubChem CID15470829
Molecular FormulaC14H20NSi+
Molecular Weight230.41 g/mol
Exact Mass230.14
IUPAC Namedimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium
SMILESC[N+](C)=C(C#C[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C14H20NSi/c1-15(2)14(11-12-16(3,4)5)13-9-7-6-8-10-13/h6-10H,1-5H3/q+1
InChIKeyFSMLRKQANKQYKT-UHFFFAOYSA-N
XLogP2.63
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.41
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

Dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium;trifluoromethanesulfonate
CID 15470828
N-methyl-1-(2-trimethylsilylphenyl)methanimine
CID 10921350
(E)-1-phenyl-N-trimethylsilylethanimine
CID 11355979
1-Phenyl-N-[(trimethylsilyl)methyl]methanimine
CID 69553009
(NZ)-N-(1-phenyl-3-trimethylsilylprop-2-ynylidene)hydroxylamine
CID 140707801
1-phenyl-N-(2-phenylethynyl)-3-tri(propan-2-yl)silylprop-2-yn-1-imine
CID 10937898
Tert-butyl-(2-diazo-2-phenylethyl)-dimethylsilane
CID 10944736
(E)-1-phenyl-N-(trimethylsilylmethyl)methanimine
CID 11052464
N-ethyl-1-phenyl-3-trimethylsilylprop-2-yn-1-imine
CID 11831225
(E)-1-phenyl-N-trimethylsilylpentan-1-imine
CID 12930777
3-Pentyn-1-amine, N-(phenylmethylene)-5-(trimethylsilyl)-
CID 13434252
1-phenyl-N-[(Z)-5-trimethylsilylpent-3-enyl]methanimine
CID 13434270

Frequently Asked Questions

What is the IUPAC name of dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium?
The IUPAC name of dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium (CID 15470829) is dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium.
What is the SMILES notation for dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium?
The canonical SMILES for dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium is C[N+](C)=C(C#C[Si](C)(C)C)c1ccccc1.
What is the InChIKey of dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium?
The InChIKey is FSMLRKQANKQYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20NSi/c1-15(2)14(11-12-16(3,4)5)13-9-7-6-8-10-13/h6-10H,1-5H3/q+1.
What are the key properties of dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium?
dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium has a molecular weight of 230.41 g/mol, XLogP of 2.63, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(1-phenyl-3-trimethylsilylprop-2-ynylidene)azanium is sourced from PubChem (CID 15470829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).