1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione

C19H39NO6Si3 — CID 11730245

IUPAC1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione
SMILESC[Si](C)(C)OC[C@H]1O[C@H](N2C(=O)CCC2=O)C[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C
InChIInChI=1S/C19H39NO6Si3/c1-27(2,3)23-13-15-19(26-29(7,8)9)14(25-28(4,5)6)12-18(24-15)20-16(21)10-11-17(20)22/h14-15,18-19H,10-13H2,1-9H3/t14-,15-,18+,19+/m1/s1
InChIKeyUVIVQYIPENODOS-LTDCPUDJSA-N
MW461.78 g/mol
LogP3.54
Rot. Bonds8

About 1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione

1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione (PubChem CID 11730245) has the molecular formula C19H39NO6Si3 and a molecular weight of 461.78 g/mol. Its IUPAC name is 1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione
PubChem CID11730245
Molecular FormulaC19H39NO6Si3
Molecular Weight461.78 g/mol
Exact Mass461.21
IUPAC Name1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione
SMILESC[Si](C)(C)OC[C@H]1O[C@H](N2C(=O)CCC2=O)C[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C
InChIInChI=1S/C19H39NO6Si3/c1-27(2,3)23-13-15-19(26-29(7,8)9)14(25-28(4,5)6)12-18(24-15)20-16(21)10-11-17(20)22/h14-15,18-19H,10-13H2,1-9H3/t14-,15-,18+,19+/m1/s1
InChIKeyUVIVQYIPENODOS-LTDCPUDJSA-N
XLogP3.54
TPSA74.30 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.78
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[(2R,3R,4R,5R)-4-trimethylsilyloxy-2,5-bis(trimethylsilyloxymethyl)oxolan-3-yl]oxysilane
CID 91750468
1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
CID 6427735
5-methyl-1-[(2R,4S,5R)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
CID 90912443
[(2R,3R,4S,5R,6R)-2-iodo-3,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-4-yl]oxy-trimethylsilane
CID 11490106
trimethyl-[(2R,3S,5S)-5-trimethylsilyloxy-2-(trimethylsilyloxymethyl)oxolan-3-yl]oxysilane
CID 6427856
trimethyl-[[(3S,6R)-3,4,5,6-tetrakis(trimethylsilyloxy)oxan-2-yl]methoxy]silane
CID 6427996
trimethyl-[[(2R,3R,4S,5S)-3,4,5,6-tetrakis(trimethylsilyloxy)oxan-2-yl]methoxy]silane
CID 22211662
trimethyl-[[(2R,3R,4S,5R,6R)-3,4,5,6-tetrakis(trimethylsilyloxy)oxan-2-yl]methoxy]silane
CID 11038830
1-[(2S,3R,4S,5R,6R)-3,4,5-tris[[tert-butyl(dimethyl)silyl]oxy]-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]pyrrolidine-2,5-dione
CID 10556809
bis(trimethylsilyl) [3,4,6-tris(trimethylsilyloxy)oxan-2-yl]methyl phosphate
CID 553822
N-trimethylsilyl-6-trimethylsilyloxy-7-[(2R,4S,5R)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]purin-2-amine
CID 6431574
N-trimethylsilyl-9-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]purin-6-amine
CID 6431571

Frequently Asked Questions

What is the IUPAC name of 1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione?
The IUPAC name of 1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione (CID 11730245) is 1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione?
The canonical SMILES for 1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione is C[Si](C)(C)OC[C@H]1O[C@H](N2C(=O)CCC2=O)C[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C.
What is the InChIKey of 1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione?
The InChIKey is UVIVQYIPENODOS-LTDCPUDJSA-N. The full InChI is InChI=1S/C19H39NO6Si3/c1-27(2,3)23-13-15-19(26-29(7,8)9)14(25-28(4,5)6)12-18(24-15)20-16(21)10-11-17(20)22/h14-15,18-19H,10-13H2,1-9H3/t14-,15-,18+,19+/m1/s1.
What are the key properties of 1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione?
1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione has a molecular weight of 461.78 g/mol, XLogP of 3.54, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S,4R,5R,6R)-4,5-bis(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-yl]pyrrolidine-2,5-dione is sourced from PubChem (CID 11730245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).