N-cyano N'-(2,2-dimethylpropyl)-2-pyridinecarboximidamide

HCID 19734543

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: CC(C)(C)CN=C(NC#N)c1ccccn1
InChIKey: NRPJIJIJXBUXCA-UHFFFAOYSA-N
Molecular formula: C12H16N4
Average molar mass: 216.28 g/mol

Names & identifiers

Preferred name: N-cyano N'-(2,2-dimethylpropyl)-2-pyridinecarboximidamide
IUPAC: N-cyano-N'-(2,2-dimethylpropyl)pyridine-2-carboximidamide

Names & synonyms

SCHEMBL9216880SCHEMBL9216882SCHEMBL9219153NRPJIJIJXBUXCA-UHFFFAOYSA-NN-cyano N'-(2,2-dimethylpropyl)-2-pyridinecarboximidamideN-cyano-N'-(2,2-dimethylpropyl)-2-pyridinecarboximidamide

Database identifiers

PubChem CID: 19734543

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 61.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 16
Formal charge: 0
Complexity: 292

Related reactions

4 records

New reaction record

HRID 327088As productuspto-grants-1993_12

HRID 374132As productuspto-grants-1992_11

HRID 697857As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 1588505As productuspto-grants-1993_06

Compound notes

Loading…