(2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol

C11H25NO4Si — CID 166524490

IUPAC(2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol
SMILESC[Si](C)(C)CC[C@]1(CO)NC[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C11H25NO4Si/c1-17(2,3)5-4-11(7-13)10(16)9(15)8(14)6-12-11/h8-10,12-16H,4-7H2,1-3H3/t8-,9+,10-,11+/m0/s1
InChIKeyOSJLYAXMCRVPHX-ZRUFSTJUSA-N
MW263.41 g/mol
LogP-0.87
Rot. Bonds4

About (2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol

(2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol (PubChem CID 166524490) has the molecular formula C11H25NO4Si and a molecular weight of 263.41 g/mol. Its IUPAC name is (2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol.

Molecular Properties

Compound Name(2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol
PubChem CID166524490
Molecular FormulaC11H25NO4Si
Molecular Weight263.41 g/mol
Exact Mass263.16
IUPAC Name(2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol
SMILESC[Si](C)(C)CC[C@]1(CO)NC[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C11H25NO4Si/c1-17(2,3)5-4-11(7-13)10(16)9(15)8(14)6-12-11/h8-10,12-16H,4-7H2,1-3H3/t8-,9+,10-,11+/m0/s1
InChIKeyOSJLYAXMCRVPHX-ZRUFSTJUSA-N
XLogP-0.87
TPSA92.95 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 5-0.87
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(2R,3R,4R,5S)-2-ethyl-2-(hydroxymethyl)piperidine-3,4,5-triol
CID 164611552
(2S,3R,4R,5S)-2-hexyl-2-(hydroxymethyl)piperidine-3,4,5-triol;hydrochloride
CID 164609572
(2S,3R,4R,5S)-2-(hydroxymethyl)-2-nonylpiperidine-3,4,5-triol;hydrochloride
CID 164628094
(2R,3R,4R,5S)-2-(hydroxymethyl)-2-(3-phenylpropyl)piperidine-3,4,5-triol
CID 166524489
3-prop-2-enyl-1-sulfanyl-1-[[3,4,5-trihydroxy-2-(hydroxymethyl)piperidin-2-yl]methyl]urea
CID 88750270
5-(hydroxymethyl)-6,6-dimethylpiperidine-3,4-diol
CID 123332942
(6R,7R,8S)-8-[(1S)-1-fluoroethyl]-4-azaspiro[2.5]octane-6,7-diol
CID 118199308
(2S,3S,4R,5S)-2-fluoro-2-(hydroxymethyl)oxane-3,4,5-triol
CID 78226014
2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-(2-trimethylsilylethyl)-3H-purin-6-ol
CID 149159415
(3R,5R)-piperidine-3,4,5-triol
CID 10464382
(6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol
CID 84647976
(2R,3S,4R,5S)-2-(hydroxymethyl)-2-methoxyoxane-3,4,5-triol
CID 101231917

Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol?
The IUPAC name of (2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol (CID 166524490) is (2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol.
What is the SMILES notation for (2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol?
The canonical SMILES for (2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol is C[Si](C)(C)CC[C@]1(CO)NC[C@H](O)[C@@H](O)[C@@H]1O.
What is the InChIKey of (2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol?
The InChIKey is OSJLYAXMCRVPHX-ZRUFSTJUSA-N. The full InChI is InChI=1S/C11H25NO4Si/c1-17(2,3)5-4-11(7-13)10(16)9(15)8(14)6-12-11/h8-10,12-16H,4-7H2,1-3H3/t8-,9+,10-,11+/m0/s1.
What are the key properties of (2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol?
(2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol has a molecular weight of 263.41 g/mol, XLogP of -0.87, 4 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R,5S)-2-(hydroxymethyl)-2-(2-trimethylsilylethyl)piperidine-3,4,5-triol is sourced from PubChem (CID 166524490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).