N-(2,5-dioxopyrrolidin-1-yl)oxyformamide

C5H6N2O4 — CID 88980282

IUPACN-(2,5-dioxopyrrolidin-1-yl)oxyformamide
SMILESO=CNON1C(=O)CCC1=O
InChIInChI=1S/C5H6N2O4/c8-3-6-11-7-4(9)1-2-5(7)10/h3H,1-2H2,(H,6,8)
InChIKeyDAYZZCCIKYQKQH-UHFFFAOYSA-N
MW158.11 g/mol
LogP-1.27
Rot. Bonds3

About N-(2,5-dioxopyrrolidin-1-yl)oxyformamide

N-(2,5-dioxopyrrolidin-1-yl)oxyformamide (PubChem CID 88980282) has the molecular formula C5H6N2O4 and a molecular weight of 158.11 g/mol. Its IUPAC name is N-(2,5-dioxopyrrolidin-1-yl)oxyformamide.

Molecular Properties

Compound NameN-(2,5-dioxopyrrolidin-1-yl)oxyformamide
PubChem CID88980282
Molecular FormulaC5H6N2O4
Molecular Weight158.11 g/mol
Exact Mass158.03
IUPAC NameN-(2,5-dioxopyrrolidin-1-yl)oxyformamide
SMILESO=CNON1C(=O)CCC1=O
InChIInChI=1S/C5H6N2O4/c8-3-6-11-7-4(9)1-2-5(7)10/h3H,1-2H2,(H,6,8)
InChIKeyDAYZZCCIKYQKQH-UHFFFAOYSA-N
XLogP-1.27
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.11
LogP ≤ 5-1.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

(2,5-dioxopyrrolidin-1-yl) 2-formamidoacetate
CID 59502327
(2,5-dioxopyrrolidin-1-yl) 2-oxoacetate
CID 58362051
1,1-dimethylcyclopropane;(2,5-dioxopyrrolidin-1-yl) formate
CID 164604016
1-(pentylamino)oxypyrrolidine-2,5-dione
CID 121327538
[(2,5-dioxopyrrolidin-1-yl)amino] formate
CID 89105288
bis(2,5-dioxopyrrolidin-1-yl) (Z)-but-2-enedioate
CID 121006912
tris(2,5-dioxopyrrolidin-1-yl) phosphate
CID 130416779
(2,5-dioxopyrrolidin-1-yl) N-hydroxycarbamate
CID 87500433
bis(bis(2,5-dioxopyrrolidin-1-yl) carbonate);carbonic acid
CID 174941778
1-methoxyazepane-2,7-dione
CID 134892605
(Z,4S)-4-(2,5-dioxopyrrolidin-1-yl)oxypent-2-enenitrile
CID 11644073
(Z)-4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobut-2-enoic acid
CID 87272120

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dioxopyrrolidin-1-yl)oxyformamide?
The IUPAC name of N-(2,5-dioxopyrrolidin-1-yl)oxyformamide (CID 88980282) is N-(2,5-dioxopyrrolidin-1-yl)oxyformamide.
What is the SMILES notation for N-(2,5-dioxopyrrolidin-1-yl)oxyformamide?
The canonical SMILES for N-(2,5-dioxopyrrolidin-1-yl)oxyformamide is O=CNON1C(=O)CCC1=O.
What is the InChIKey of N-(2,5-dioxopyrrolidin-1-yl)oxyformamide?
The InChIKey is DAYZZCCIKYQKQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O4/c8-3-6-11-7-4(9)1-2-5(7)10/h3H,1-2H2,(H,6,8).
What are the key properties of N-(2,5-dioxopyrrolidin-1-yl)oxyformamide?
N-(2,5-dioxopyrrolidin-1-yl)oxyformamide has a molecular weight of 158.11 g/mol, XLogP of -1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dioxopyrrolidin-1-yl)oxyformamide is sourced from PubChem (CID 88980282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).