(2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol

C9H23NO2Si — CID 101238862

IUPAC(2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol
SMILESCC(C)(C)[Si](C)(C)OC[C@@H](N)CO
InChIInChI=1S/C9H23NO2Si/c1-9(2,3)13(4,5)12-7-8(10)6-11/h8,11H,6-7,10H2,1-5H3/t8-/m0/s1
InChIKeyLPLDCSWTBSTLOX-QMMMGPOBSA-N
MW205.37 g/mol
LogP1.33
Rot. Bonds4

About (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol

(2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol (PubChem CID 101238862) has the molecular formula C9H23NO2Si and a molecular weight of 205.37 g/mol. Its IUPAC name is (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol.

Molecular Properties

Compound Name(2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol
PubChem CID101238862
Molecular FormulaC9H23NO2Si
Molecular Weight205.37 g/mol
Exact Mass205.15
IUPAC Name(2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol
SMILESCC(C)(C)[Si](C)(C)OC[C@@H](N)CO
InChIInChI=1S/C9H23NO2Si/c1-9(2,3)13(4,5)12-7-8(10)6-11/h8,11H,6-7,10H2,1-5H3/t8-/m0/s1
InChIKeyLPLDCSWTBSTLOX-QMMMGPOBSA-N
XLogP1.33
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.37
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol with MolForge

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

Launch Full Analysis

Related Compounds

2-amino-3-trimethylsilyloxypropan-1-ol
CID 130579064
(3S)-4-[tert-butyl(dimethyl)silyl]oxybutane-1,3-diamine
CID 87682388
(2S,3R)-4-[tert-butyl(dimethyl)silyl]oxy-2-iodobutane-1,3-diol
CID 102271148
1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine
CID 53427177
1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol
CID 13175134
(2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride
CID 50999200
(2R,4S)-5-[tert-butyl(dimethyl)silyl]oxy-2-(trifluoromethyl)pentane-1,4-diol
CID 11833579
tert-butyl (2R)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropanoate
CID 132916594
(2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol
CID 11486689
(2S)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-ol
CID 86606837
(2R)-2-amino-3-[tert-butyl(diphenyl)silyl]oxypropan-1-ol
CID 129407863
[2-bromo-3-[tert-butyl(dimethyl)silyl]oxypropoxy]-tert-butyl-dimethylsilane
CID 125380572

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol?
The IUPAC name of (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol (CID 101238862) is (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol.
What is the SMILES notation for (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol?
The canonical SMILES for (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol is CC(C)(C)[Si](C)(C)OC[C@@H](N)CO.
What is the InChIKey of (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol?
The InChIKey is LPLDCSWTBSTLOX-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H23NO2Si/c1-9(2,3)13(4,5)12-7-8(10)6-11/h8,11H,6-7,10H2,1-5H3/t8-/m0/s1.
What are the key properties of (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol?
(2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol has a molecular weight of 205.37 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-3-[tert-butyl(dimethyl)silyl]oxypropan-1-ol is sourced from PubChem (CID 101238862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).