Cotinine 3D structure

Cotinine (also called Cotinina, Cotininum) has the formula C₁₀H₁₂N₂O and a molar mass of 176.21 g/mol. The model above is PubChem's computed 3D conformer: drag to rotate, scroll to zoom, and use the measurement tools to read bond lengths and angles.

Formula: C₁₀H₁₂N₂O
Molar mass: 176.21 g/mol
PubChem CID: 854019
Heavy atoms: 13
Category: Stimulants

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC name	(5S)-1-methyl-5-pyridin-3-ylpyrrolidin-2-one
SMILES	`CN1[C@@H](CCC1=O)C2=CN=CC=C2`
PubChem CID	854019
Other names	Cotinina, Cotininum, Scotine, Pharmakon1600-01500208, NC01 - Nicotine and Cotinine in Urine

How to read the 3D model

Atoms use the standard CPK colors: carbon gray, hydrogen white, oxygen red, nitrogen blue, sulfur yellow. Switch to Spacefill to see the molecule's overall shape and size, or Stick for a clear view of the bonds. Click two atoms in distance mode to measure a bond length in ångströms.

3D coordinates are PubChem's computed conformer, one low-energy shape of the molecule. Flexible molecules can take many other shapes.

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