(2-oxopyrrolidin-1-yl)methyl hypoiodite

C5H8INO2 — CID 166778637

IUPAC(2-oxopyrrolidin-1-yl)methyl hypoiodite
SMILESO=C1CCCN1COI
InChIInChI=1S/C5H8INO2/c6-9-4-7-3-1-2-5(7)8/h1-4H2
InChIKeyKFKWQXOZSXNCFD-UHFFFAOYSA-N
MW241.03 g/mol
LogP0.93
Rot. Bonds2

About (2-oxopyrrolidin-1-yl)methyl hypoiodite

(2-oxopyrrolidin-1-yl)methyl hypoiodite (PubChem CID 166778637) has the molecular formula C5H8INO2 and a molecular weight of 241.03 g/mol. Its IUPAC name is (2-oxopyrrolidin-1-yl)methyl hypoiodite.

Molecular Properties

Compound Name(2-oxopyrrolidin-1-yl)methyl hypoiodite
PubChem CID166778637
Molecular FormulaC5H8INO2
Molecular Weight241.03 g/mol
Exact Mass240.96
IUPAC Name(2-oxopyrrolidin-1-yl)methyl hypoiodite
SMILESO=C1CCCN1COI
InChIInChI=1S/C5H8INO2/c6-9-4-7-3-1-2-5(7)8/h1-4H2
InChIKeyKFKWQXOZSXNCFD-UHFFFAOYSA-N
XLogP0.93
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.03
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-oxopyrrolidin-1-yl)methyl hypoiodite?
The IUPAC name of (2-oxopyrrolidin-1-yl)methyl hypoiodite (CID 166778637) is (2-oxopyrrolidin-1-yl)methyl hypoiodite.
What is the SMILES notation for (2-oxopyrrolidin-1-yl)methyl hypoiodite?
The canonical SMILES for (2-oxopyrrolidin-1-yl)methyl hypoiodite is O=C1CCCN1COI.
What is the InChIKey of (2-oxopyrrolidin-1-yl)methyl hypoiodite?
The InChIKey is KFKWQXOZSXNCFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8INO2/c6-9-4-7-3-1-2-5(7)8/h1-4H2.
What are the key properties of (2-oxopyrrolidin-1-yl)methyl hypoiodite?
(2-oxopyrrolidin-1-yl)methyl hypoiodite has a molecular weight of 241.03 g/mol, XLogP of 0.93, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxopyrrolidin-1-yl)methyl hypoiodite is sourced from PubChem (CID 166778637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).