1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione

C14H20N2O5Si2 — CID 18336004

IUPAC1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione
SMILESC[Si](C)(CN1C(=O)C=CC1=O)O[Si](C)(C)CN1C(=O)C=CC1=O
InChIInChI=1S/C14H20N2O5Si2/c1-22(2,9-15-11(17)5-6-12(15)18)21-23(3,4)10-16-13(19)7-8-14(16)20/h5-8H,9-10H2,1-4H3
InChIKeyDUBMAOCTGBSAOL-UHFFFAOYSA-N
MW352.50 g/mol
LogP0.34
Rot. Bonds6

About 1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione

1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione (PubChem CID 18336004) has the molecular formula C14H20N2O5Si2 and a molecular weight of 352.50 g/mol. Its IUPAC name is 1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione.

Molecular Properties

Compound Name1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione
PubChem CID18336004
Molecular FormulaC14H20N2O5Si2
Molecular Weight352.50 g/mol
Exact Mass352.09
IUPAC Name1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione
SMILESC[Si](C)(CN1C(=O)C=CC1=O)O[Si](C)(C)CN1C(=O)C=CC1=O
InChIInChI=1S/C14H20N2O5Si2/c1-22(2,9-15-11(17)5-6-12(15)18)21-23(3,4)10-16-13(19)7-8-14(16)20/h5-8H,9-10H2,1-4H3
InChIKeyDUBMAOCTGBSAOL-UHFFFAOYSA-N
XLogP0.34
TPSA83.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.50
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione?
The IUPAC name of 1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione (CID 18336004) is 1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione.
What is the SMILES notation for 1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione?
The canonical SMILES for 1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione is C[Si](C)(CN1C(=O)C=CC1=O)O[Si](C)(C)CN1C(=O)C=CC1=O.
What is the InChIKey of 1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione?
The InChIKey is DUBMAOCTGBSAOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O5Si2/c1-22(2,9-15-11(17)5-6-12(15)18)21-23(3,4)10-16-13(19)7-8-14(16)20/h5-8H,9-10H2,1-4H3.
What are the key properties of 1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione?
1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione has a molecular weight of 352.50 g/mol, XLogP of 0.34, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[(2,5-dioxopyrrol-1-yl)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]pyrrole-2,5-dione is sourced from PubChem (CID 18336004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).