(2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate

C10H11NO8 — CID 138749428

IUPAC(2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate
SMILESCC1=C(COC(=O)ON2C(=O)CCC2=O)OC(O)O1
InChIInChI=1S/C10H11NO8/c1-5-6(18-10(15)17-5)4-16-9(14)19-11-7(12)2-3-8(11)13/h10,15H,2-4H2,1H3
InChIKeyMZANDJHKBVOECP-UHFFFAOYSA-N
MW273.20 g/mol
LogP-0.24
Rot. Bonds3

About (2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate

(2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate (PubChem CID 138749428) has the molecular formula C10H11NO8 and a molecular weight of 273.20 g/mol. Its IUPAC name is (2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate.

Molecular Properties

Compound Name(2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate
PubChem CID138749428
Molecular FormulaC10H11NO8
Molecular Weight273.20 g/mol
Exact Mass273.05
IUPAC Name(2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate
SMILESCC1=C(COC(=O)ON2C(=O)CCC2=O)OC(O)O1
InChIInChI=1S/C10H11NO8/c1-5-6(18-10(15)17-5)4-16-9(14)19-11-7(12)2-3-8(11)13/h10,15H,2-4H2,1H3
InChIKeyMZANDJHKBVOECP-UHFFFAOYSA-N
XLogP-0.24
TPSA111.60 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.20
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

bis(2,5-dioxopyrrolidin-1-yl) carbonate;(2,5-dioxopyrrolidin-1-yl) (4-methylphenyl)methyl carbonate
CID 162254315
(2,5-dioxopyrrolidin-1-yl) 2-methoxyethyl carbonate
CID 59130156
(2,5-dioxopyrrolidin-1-yl) 2-methylpropyl carbonate
CID 19911288
(2,5-dioxopyrrolidin-1-yl) [(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxymethyldisulfanyl]methyl carbonate
CID 90051305
(2,5-dioxopyrrolidin-1-yl) 2-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethylsulfinyl]ethyl carbonate
CID 175094231
2-cyanoethyl (2,5-dioxopyrrolidin-1-yl) carbonate
CID 10632308
(4-cyclopropylphenyl)methyl (2,5-dioxopyrrolidin-1-yl) carbonate
CID 23577252
bis(bis(2,5-dioxopyrrolidin-1-yl) carbonate);carbonic acid
CID 174941778
(2,5-dioxopyrrolidin-1-yl) [2-(2,5-dioxopyrrolidin-1-yl)-2-oxoethyl] carbonate
CID 159138690
cyclohexylmethyl (2,5-dioxopyrrolidin-1-yl) carbonate
CID 87384668
dichloromethane;(2,5-dioxopyrrolidin-1-yl) 1,3-oxazol-5-ylmethyl carbonate
CID 159499892
(2,5-dioxopyrrolidin-1-yl) pent-4-ynyl carbonate
CID 169105698

Frequently Asked Questions

What is the IUPAC name of (2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate?
The IUPAC name of (2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate (CID 138749428) is (2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate.
What is the SMILES notation for (2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate?
The canonical SMILES for (2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate is CC1=C(COC(=O)ON2C(=O)CCC2=O)OC(O)O1.
What is the InChIKey of (2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate?
The InChIKey is MZANDJHKBVOECP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO8/c1-5-6(18-10(15)17-5)4-16-9(14)19-11-7(12)2-3-8(11)13/h10,15H,2-4H2,1H3.
What are the key properties of (2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate?
(2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate has a molecular weight of 273.20 g/mol, XLogP of -0.24, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dioxopyrrolidin-1-yl) (2-hydroxy-5-methyl-1,3-dioxol-4-yl)methyl carbonate is sourced from PubChem (CID 138749428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).