trimethylsilyl (2S)-2-aminopentanoate

C8H19NO2Si — CID 140849909

IUPACtrimethylsilyl (2S)-2-aminopentanoate
SMILESCCC[C@H](N)C(=O)O[Si](C)(C)C
InChIInChI=1S/C8H19NO2Si/c1-5-6-7(9)8(10)11-12(2,3)4/h7H,5-6,9H2,1-4H3/t7-/m0/s1
InChIKeyNGMDLMNCABQTGP-ZETCQYMHSA-N
MW189.33 g/mol
LogP1.49
Rot. Bonds4

About trimethylsilyl (2S)-2-aminopentanoate

trimethylsilyl (2S)-2-aminopentanoate (PubChem CID 140849909) has the molecular formula C8H19NO2Si and a molecular weight of 189.33 g/mol. Its IUPAC name is trimethylsilyl (2S)-2-aminopentanoate.

Molecular Properties

Compound Nametrimethylsilyl (2S)-2-aminopentanoate
PubChem CID140849909
Molecular FormulaC8H19NO2Si
Molecular Weight189.33 g/mol
Exact Mass189.12
IUPAC Nametrimethylsilyl (2S)-2-aminopentanoate
SMILESCCC[C@H](N)C(=O)O[Si](C)(C)C
InChIInChI=1S/C8H19NO2Si/c1-5-6-7(9)8(10)11-12(2,3)4/h7H,5-6,9H2,1-4H3/t7-/m0/s1
InChIKeyNGMDLMNCABQTGP-ZETCQYMHSA-N
XLogP1.49
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.33
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl 2-aminopentanoate
CID 533890
pentan-2-yl (2S)-2-aminopentanoate
CID 107565809
(2R)-2-(15N)azanyl(313C)pentanoic acid
CID 157463358
(2R)-2-amino(311C)pentanoic acid
CID 55291456
oxetan-3-yl 2-aminopentanoate
CID 102606817
heptyl 2-aminopentanoate
CID 61302463
heptyl (2R)-2-aminopentanoate
CID 107565724
trimethylsilyl 2-trimethylsilyloxyoctanoate
CID 91730031
cyclopropylmethyl (2S)-2-aminopentanoate
CID 107565685
4-aminoheptan-3-one;ethane
CID 143359235
cyclopentyl 2-aminopentanoate
CID 61278203
2-amino-N-ethoxypentanamide
CID 64974803

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl (2S)-2-aminopentanoate?
The IUPAC name of trimethylsilyl (2S)-2-aminopentanoate (CID 140849909) is trimethylsilyl (2S)-2-aminopentanoate.
What is the SMILES notation for trimethylsilyl (2S)-2-aminopentanoate?
The canonical SMILES for trimethylsilyl (2S)-2-aminopentanoate is CCC[C@H](N)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl (2S)-2-aminopentanoate?
The InChIKey is NGMDLMNCABQTGP-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H19NO2Si/c1-5-6-7(9)8(10)11-12(2,3)4/h7H,5-6,9H2,1-4H3/t7-/m0/s1.
What are the key properties of trimethylsilyl (2S)-2-aminopentanoate?
trimethylsilyl (2S)-2-aminopentanoate has a molecular weight of 189.33 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl (2S)-2-aminopentanoate is sourced from PubChem (CID 140849909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).