trimethylsilyl 2-amino-3,3-dimethylbutanoate

C9H21NO2Si — CID 90102815

IUPACtrimethylsilyl 2-amino-3,3-dimethylbutanoate
SMILESCC(C)(C)C(N)C(=O)O[Si](C)(C)C
InChIInChI=1S/C9H21NO2Si/c1-9(2,3)7(10)8(11)12-13(4,5)6/h7H,10H2,1-6H3
InChIKeyCHFUINYVQDMKDH-UHFFFAOYSA-N
MW203.36 g/mol
LogP1.74
Rot. Bonds2

About trimethylsilyl 2-amino-3,3-dimethylbutanoate

trimethylsilyl 2-amino-3,3-dimethylbutanoate (PubChem CID 90102815) has the molecular formula C9H21NO2Si and a molecular weight of 203.36 g/mol. Its IUPAC name is trimethylsilyl 2-amino-3,3-dimethylbutanoate.

Molecular Properties

Compound Nametrimethylsilyl 2-amino-3,3-dimethylbutanoate
PubChem CID90102815
Molecular FormulaC9H21NO2Si
Molecular Weight203.36 g/mol
Exact Mass203.13
IUPAC Nametrimethylsilyl 2-amino-3,3-dimethylbutanoate
SMILESCC(C)(C)C(N)C(=O)O[Si](C)(C)C
InChIInChI=1S/C9H21NO2Si/c1-9(2,3)7(10)8(11)12-13(4,5)6/h7H,10H2,1-6H3
InChIKeyCHFUINYVQDMKDH-UHFFFAOYSA-N
XLogP1.74
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.36
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 trimethylsilyl 2-amino-3,3-dimethylbutanoate?
The IUPAC name of trimethylsilyl 2-amino-3,3-dimethylbutanoate (CID 90102815) is trimethylsilyl 2-amino-3,3-dimethylbutanoate.
What is the SMILES notation for trimethylsilyl 2-amino-3,3-dimethylbutanoate?
The canonical SMILES for trimethylsilyl 2-amino-3,3-dimethylbutanoate is CC(C)(C)C(N)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl 2-amino-3,3-dimethylbutanoate?
The InChIKey is CHFUINYVQDMKDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO2Si/c1-9(2,3)7(10)8(11)12-13(4,5)6/h7H,10H2,1-6H3.
What are the key properties of trimethylsilyl 2-amino-3,3-dimethylbutanoate?
trimethylsilyl 2-amino-3,3-dimethylbutanoate has a molecular weight of 203.36 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2-amino-3,3-dimethylbutanoate is sourced from PubChem (CID 90102815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).