4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine

C17H39NSi2 — CID 173110567

IUPAC4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine
SMILESCCCC(NC(CC)C(C)=C(C)[SiH3])[Si](CC)(CC)CC
InChIInChI=1S/C17H39NSi2/c1-8-13-17(20(10-3,11-4)12-5)18-16(9-2)14(6)15(7)19/h16-18H,8-13H2,1-7,19H3
InChIKeyGMBKOWAVTKEHSP-UHFFFAOYSA-N
MW313.68 g/mol
LogP4.23
Rot. Bonds10

About 4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine

4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine (PubChem CID 173110567) has the molecular formula C17H39NSi2 and a molecular weight of 313.68 g/mol. Its IUPAC name is 4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine.

Molecular Properties

Compound Name4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine
PubChem CID173110567
Molecular FormulaC17H39NSi2
Molecular Weight313.68 g/mol
Exact Mass313.26
IUPAC Name4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine
SMILESCCCC(NC(CC)C(C)=C(C)[SiH3])[Si](CC)(CC)CC
InChIInChI=1S/C17H39NSi2/c1-8-13-17(20(10-3,11-4)12-5)18-16(9-2)14(6)15(7)19/h16-18H,8-13H2,1-7,19H3
InChIKeyGMBKOWAVTKEHSP-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.68
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine?
The IUPAC name of 4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine (CID 173110567) is 4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine.
What is the SMILES notation for 4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine?
The canonical SMILES for 4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine is CCCC(NC(CC)C(C)=C(C)[SiH3])[Si](CC)(CC)CC.
What is the InChIKey of 4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine?
The InChIKey is GMBKOWAVTKEHSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H39NSi2/c1-8-13-17(20(10-3,11-4)12-5)18-16(9-2)14(6)15(7)19/h16-18H,8-13H2,1-7,19H3.
What are the key properties of 4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine?
4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine has a molecular weight of 313.68 g/mol, XLogP of 4.23, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-silyl-N-(1-triethylsilylbutyl)hex-4-en-3-amine is sourced from PubChem (CID 173110567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).