[[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol

C20H29NO2Si — CID 58715062

IUPAC[[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol
SMILESC[C@H](CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)NCO
InChIInChI=1S/C20H29NO2Si/c1-17(21-16-22)15-23-24(20(2,3)4,18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,17,21-22H,15-16H2,1-4H3/t17-/m1/s1
InChIKeyGSGCOLSWMLWCTR-QGZVFWFLSA-N
MW343.54 g/mol
LogP2.49
Rot. Bonds7

About [[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol

[[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol (PubChem CID 58715062) has the molecular formula C20H29NO2Si and a molecular weight of 343.54 g/mol. Its IUPAC name is [[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol.

Molecular Properties

Compound Name[[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol
PubChem CID58715062
Molecular FormulaC20H29NO2Si
Molecular Weight343.54 g/mol
Exact Mass343.20
IUPAC Name[[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol
SMILESC[C@H](CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)NCO
InChIInChI=1S/C20H29NO2Si/c1-17(21-16-22)15-23-24(20(2,3)4,18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,17,21-22H,15-16H2,1-4H3/t17-/m1/s1
InChIKeyGSGCOLSWMLWCTR-QGZVFWFLSA-N
XLogP2.49
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.54
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol?
The IUPAC name of [[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol (CID 58715062) is [[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol.
What is the SMILES notation for [[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol?
The canonical SMILES for [[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol is C[C@H](CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)NCO.
What is the InChIKey of [[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol?
The InChIKey is GSGCOLSWMLWCTR-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H29NO2Si/c1-17(21-16-22)15-23-24(20(2,3)4,18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,17,21-22H,15-16H2,1-4H3/t17-/m1/s1.
What are the key properties of [[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol?
[[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol has a molecular weight of 343.54 g/mol, XLogP of 2.49, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol is sourced from PubChem (CID 58715062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).