(2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid

C20H27NO3Si — CID 10981189

IUPAC(2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid
SMILESC[C@@H](O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)[C@H](N)C(=O)O
InChIInChI=1S/C20H27NO3Si/c1-15(18(21)19(22)23)24-25(20(2,3)4,16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5-15,18H,21H2,1-4H3,(H,22,23)/t15-,18+/m1/s1
InChIKeyVWWPJZHACDRSFD-QAPCUYQASA-N
MW357.53 g/mol
LogP2.36
Rot. Bonds6

About (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid

(2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid (PubChem CID 10981189) has the molecular formula C20H27NO3Si and a molecular weight of 357.53 g/mol. Its IUPAC name is (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid.

Molecular Properties

Compound Name(2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid
PubChem CID10981189
Molecular FormulaC20H27NO3Si
Molecular Weight357.53 g/mol
Exact Mass357.18
IUPAC Name(2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid
SMILESC[C@@H](O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)[C@H](N)C(=O)O
InChIInChI=1S/C20H27NO3Si/c1-15(18(21)19(22)23)24-25(20(2,3)4,16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5-15,18H,21H2,1-4H3,(H,22,23)/t15-,18+/m1/s1
InChIKeyVWWPJZHACDRSFD-QAPCUYQASA-N
XLogP2.36
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.53
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Methyl O-[tert-butyl(diphenyl)silyl]serinate
CID 11210526
(2S)-2-amino-3-[tert-butyl(diphenyl)silyl]oxypropanoic acid
CID 16753285
(3S)-3-amino-4-[tert-butyl(diphenyl)silyl]oxybutanoic acid
CID 56646881
(2S,3R)-2-tert-Butoxycarbonylamino-3-(tert-butyl-diphenyl-silanyloxy)-butyric acid
CID 86709669
3-[(Tert-butyldiphenylsilyl)oxy]butanoic acid
CID 21939286
(2S,3S)-tert-butyl 3-((tert-butyldiphenylsilyl)oxy)-2-(methylamino)pent-4-enoate
CID 24773749
diphenylboranyl (2S)-2-amino-3-hydroxybutanoate
CID 134867320
bis(4-fluorophenyl)boranyl (2S,3R)-2-amino-3-hydroxybutanoate
CID 177387131
3-[Tert-butyl(diphenyl)silyl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
CID 499093
methyl (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoate
CID 10809249
Diphenylboranyl 2-amino-3-hydroxybutanoate
CID 15607057
2-Amino-6-[tert-butyl(diphenyl)silyl]oxy-3-hydroxyoct-7-enoic acid
CID 20245341

Frequently Asked Questions

What is the IUPAC name of (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid?
The IUPAC name of (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid (CID 10981189) is (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid.
What is the SMILES notation for (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid?
The canonical SMILES for (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid is C[C@@H](O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)[C@H](N)C(=O)O.
What is the InChIKey of (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid?
The InChIKey is VWWPJZHACDRSFD-QAPCUYQASA-N. The full InChI is InChI=1S/C20H27NO3Si/c1-15(18(21)19(22)23)24-25(20(2,3)4,16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5-15,18H,21H2,1-4H3,(H,22,23)/t15-,18+/m1/s1.
What are the key properties of (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid?
(2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid has a molecular weight of 357.53 g/mol, XLogP of 2.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxybutanoic acid is sourced from PubChem (CID 10981189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).