trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate

C15H31NO3Si — CID 165044908

IUPACtrimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate
SMILESCC(C)[C@H](C)C(=O)N(C)[C@H](C(=O)O[Si](C)(C)C)C(C)C
InChIInChI=1S/C15H31NO3Si/c1-10(2)12(5)14(17)16(6)13(11(3)4)15(18)19-20(7,8)9/h10-13H,1-9H3/t12-,13-/m0/s1
InChIKeyCGHHFCBARGGFKS-STQMWFEESA-N
MW301.50 g/mol
LogP3.14
Rot. Bonds6

About trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate

trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate (PubChem CID 165044908) has the molecular formula C15H31NO3Si and a molecular weight of 301.50 g/mol. Its IUPAC name is trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate.

Molecular Properties

Compound Nametrimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate
PubChem CID165044908
Molecular FormulaC15H31NO3Si
Molecular Weight301.50 g/mol
Exact Mass301.21
IUPAC Nametrimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate
SMILESCC(C)[C@H](C)C(=O)N(C)[C@H](C(=O)O[Si](C)(C)C)C(C)C
InChIInChI=1S/C15H31NO3Si/c1-10(2)12(5)14(17)16(6)13(11(3)4)15(18)19-20(7,8)9/h10-13H,1-9H3/t12-,13-/m0/s1
InChIKeyCGHHFCBARGGFKS-STQMWFEESA-N
XLogP3.14
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.50
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate?
The IUPAC name of trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate (CID 165044908) is trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate.
What is the SMILES notation for trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate?
The canonical SMILES for trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate is CC(C)[C@H](C)C(=O)N(C)[C@H](C(=O)O[Si](C)(C)C)C(C)C.
What is the InChIKey of trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate?
The InChIKey is CGHHFCBARGGFKS-STQMWFEESA-N. The full InChI is InChI=1S/C15H31NO3Si/c1-10(2)12(5)14(17)16(6)13(11(3)4)15(18)19-20(7,8)9/h10-13H,1-9H3/t12-,13-/m0/s1.
What are the key properties of trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate?
trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate has a molecular weight of 301.50 g/mol, XLogP of 3.14, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl (2S)-2-[[(2S)-2,3-dimethylbutanoyl]-methylamino]-3-methylbutanoate is sourced from PubChem (CID 165044908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).