1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione

C15H28N2O5Si2 — CID 6427735

IUPAC1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
SMILESC[Si](C)(C)OC[C@@H]1OC(n2ccc(=O)[nH]c2=O)C[C@H]1O[Si](C)(C)C
InChIInChI=1S/C15H28N2O5Si2/c1-23(2,3)20-10-12-11(22-24(4,5)6)9-14(21-12)17-8-7-13(18)16-15(17)19/h7-8,11-12,14H,9-10H2,1-6H3,(H,16,18,19)/t11-,12+,14?/m1/s1
InChIKeyUWMUHCLOWACYQQ-RJTITELWSA-N
MW372.57 g/mol
LogP1.90
Rot. Bonds6

About 1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione

1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione (PubChem CID 6427735) has the molecular formula C15H28N2O5Si2 and a molecular weight of 372.57 g/mol. Its IUPAC name is 1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
PubChem CID6427735
Molecular FormulaC15H28N2O5Si2
Molecular Weight372.57 g/mol
Exact Mass372.15
IUPAC Name1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
SMILESC[Si](C)(C)OC[C@@H]1OC(n2ccc(=O)[nH]c2=O)C[C@H]1O[Si](C)(C)C
InChIInChI=1S/C15H28N2O5Si2/c1-23(2,3)20-10-12-11(22-24(4,5)6)9-14(21-12)17-8-7-13(18)16-15(17)19/h7-8,11-12,14H,9-10H2,1-6H3,(H,16,18,19)/t11-,12+,14?/m1/s1
InChIKeyUWMUHCLOWACYQQ-RJTITELWSA-N
XLogP1.90
TPSA82.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.57
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

5-methyl-1-[(2R,4S,5R)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
CID 90912443
[(2R,3S,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-methylsulfonyloxyoxolan-2-yl]methyl methanesulfonate
CID 11246083
1-[4,5-bis(methoxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
CID 123691114
1-[(2R,4S,5R)-4-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]-5-deuteriopyrimidine-2,4-dione
CID 14311092
1-[(2R,4S,5R)-5-(ethoxymethyl)-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione
CID 22837617
1-[(2R,5R)-4,5-diethyloxolan-2-yl]pyrimidine-2,4-dione
CID 58159388
1-[(2R,4S,5R)-5-ethyl-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione
CID 14562102
1-[(2R,4S,5R)-4-hydroxy-5-(sulfanyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
CID 18396706
[(3R,5R)-5-(2,4-dioxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate
CID 174149552
[(2R,3R,5R)-3-benzoyloxy-5-(2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl benzoate
CID 14412037
[5-(2,4-dioxopyrimidin-1-yl)-3-propan-2-yloxyoxolan-2-yl]methoxy-N-oxophosphonamidic acid
CID 170081776
1-[(2S,5S)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-fluorooxolan-2-yl]pyrimidine-2,4-dione
CID 68699521

Frequently Asked Questions

What is the IUPAC name of 1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione?
The IUPAC name of 1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione (CID 6427735) is 1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione.
What is the SMILES notation for 1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione?
The canonical SMILES for 1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione is C[Si](C)(C)OC[C@@H]1OC(n2ccc(=O)[nH]c2=O)C[C@H]1O[Si](C)(C)C.
What is the InChIKey of 1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione?
The InChIKey is UWMUHCLOWACYQQ-RJTITELWSA-N. The full InChI is InChI=1S/C15H28N2O5Si2/c1-23(2,3)20-10-12-11(22-24(4,5)6)9-14(21-12)17-8-7-13(18)16-15(17)19/h7-8,11-12,14H,9-10H2,1-6H3,(H,16,18,19)/t11-,12+,14?/m1/s1.
What are the key properties of 1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione?
1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione has a molecular weight of 372.57 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4R,5S)-4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione is sourced from PubChem (CID 6427735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).