2-(Cyanoimino)-N-formyl-1-pyrrolidineacetamide

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Basic information

CAS: 159383-31-0
Standard SMILES: N#CN=C1CCCN1CC(=O)NC=O
InChIKey: CGRSCZSEEIETFF-UHFFFAOYSA-N
Molecular formula: C8H10N4O2
Average molar mass: 194.19 g/mol
Monoisotopic mass: 194.08037557

Names & identifiers

Preferred name: 2-(Cyanoimino)-N-formyl-1-pyrrolidineacetamide
IUPAC: 2-(2-cyanoiminopyrrolidin-1-yl)-N-formylacetamide

Names & synonyms

2-(Cyanoimino)-N-formyl-1-pyrrolidineacetamide1-Pyrrolidineacetamide, 2-(cyanoimino)-N-formyl-1-((N-Formylcarbamido)methyl)-2-cyanoiminopyrrolidine159383-31-0AKOS024341383

Database identifiers

CAS: 159383-31-0
PubChem CID: 3074552
Nikkaji: J543.833K

Properties

Computed structural properties

XLogP: -0.7
Topological polar surface area: 85.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 315

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Compound notes

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