3-trimethylsilylprop-2-yn-1-imine

C6H11NSi — CID 15691014

IUPAC3-trimethylsilylprop-2-yn-1-imine
SMILES[H]/N=C/C#C[Si](C)(C)C
InChIInChI=1S/C6H11NSi/c1-8(2,3)6-4-5-7/h5,7H,1-3H3/b7-5+
InChIKeyDTQVPKRBCMUUFW-FNORWQNLSA-N
MW125.25 g/mol
LogP1.52
Rot. Bonds

About 3-trimethylsilylprop-2-yn-1-imine

3-trimethylsilylprop-2-yn-1-imine (PubChem CID 15691014) has the molecular formula C6H11NSi and a molecular weight of 125.25 g/mol. Its IUPAC name is 3-trimethylsilylprop-2-yn-1-imine.

Molecular Properties

Compound Name3-trimethylsilylprop-2-yn-1-imine
PubChem CID15691014
Molecular FormulaC6H11NSi
Molecular Weight125.25 g/mol
Exact Mass125.07
IUPAC Name3-trimethylsilylprop-2-yn-1-imine
SMILES[H]/N=C/C#C[Si](C)(C)C
InChIInChI=1S/C6H11NSi/c1-8(2,3)6-4-5-7/h5,7H,1-3H3/b7-5+
InChIKeyDTQVPKRBCMUUFW-FNORWQNLSA-N
XLogP1.52
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.25
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 3-trimethylsilylprop-2-yn-1-imine?
The IUPAC name of 3-trimethylsilylprop-2-yn-1-imine (CID 15691014) is 3-trimethylsilylprop-2-yn-1-imine.
What is the SMILES notation for 3-trimethylsilylprop-2-yn-1-imine?
The canonical SMILES for 3-trimethylsilylprop-2-yn-1-imine is [H]/N=C/C#C[Si](C)(C)C.
What is the InChIKey of 3-trimethylsilylprop-2-yn-1-imine?
The InChIKey is DTQVPKRBCMUUFW-FNORWQNLSA-N. The full InChI is InChI=1S/C6H11NSi/c1-8(2,3)6-4-5-7/h5,7H,1-3H3/b7-5+.
What are the key properties of 3-trimethylsilylprop-2-yn-1-imine?
3-trimethylsilylprop-2-yn-1-imine has a molecular weight of 125.25 g/mol, XLogP of 1.52, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-trimethylsilylprop-2-yn-1-imine is sourced from PubChem (CID 15691014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).