Cyclobenzaprine 3D structure

Cyclobenzaprine (also called Proheptatriene, Proheptatrien) has the formula C20H21N and a molar mass of 275.4 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
C20H21N
Molar mass
275.4 g/mol
PubChem CID
2895
Heavy atoms
21
Category
Common drugs

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC nameN,N-dimethyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)propan-1-amine
SMILESCN(C)CCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31
PubChem CID2895
Other namesProheptatriene, Proheptatrien, Ciclobenzaprina, Proeptatriene, Lisseril

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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