4-trimethylsilylbutan-2-amine

C7H19NSi — CID 55289280

IUPAC4-trimethylsilylbutan-2-amine
SMILESCC(N)CC[Si](C)(C)C
InChIInChI=1S/C7H19NSi/c1-7(8)5-6-9(2,3)4/h7H,5-6,8H2,1-4H3
InChIKeyFQDUBPQXFUMHOZ-UHFFFAOYSA-N
MW145.32 g/mol
LogP2.06
Rot. Bonds3

About 4-trimethylsilylbutan-2-amine

4-trimethylsilylbutan-2-amine (PubChem CID 55289280) has the molecular formula C7H19NSi and a molecular weight of 145.32 g/mol. Its IUPAC name is 4-trimethylsilylbutan-2-amine.

Molecular Properties

Compound Name4-trimethylsilylbutan-2-amine
PubChem CID55289280
Molecular FormulaC7H19NSi
Molecular Weight145.32 g/mol
Exact Mass145.13
IUPAC Name4-trimethylsilylbutan-2-amine
SMILESCC(N)CC[Si](C)(C)C
InChIInChI=1S/C7H19NSi/c1-7(8)5-6-9(2,3)4/h7H,5-6,8H2,1-4H3
InChIKeyFQDUBPQXFUMHOZ-UHFFFAOYSA-N
XLogP2.06
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.32
LogP ≤ 52.06
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-trimethylsilylbutan-2-amine?
The IUPAC name of 4-trimethylsilylbutan-2-amine (CID 55289280) is 4-trimethylsilylbutan-2-amine.
What is the SMILES notation for 4-trimethylsilylbutan-2-amine?
The canonical SMILES for 4-trimethylsilylbutan-2-amine is CC(N)CC[Si](C)(C)C.
What is the InChIKey of 4-trimethylsilylbutan-2-amine?
The InChIKey is FQDUBPQXFUMHOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19NSi/c1-7(8)5-6-9(2,3)4/h7H,5-6,8H2,1-4H3.
What are the key properties of 4-trimethylsilylbutan-2-amine?
4-trimethylsilylbutan-2-amine has a molecular weight of 145.32 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-trimethylsilylbutan-2-amine is sourced from PubChem (CID 55289280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).