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Molecule record

N-(3-cyanophenyl)acetamide

C9H8N2O

160.18 g/mol

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Molecular properties

Formula
C9H8N2O
Molar mass
160.18 g·mol−1
Exact mass
160.0637 Da
7
PubChem CID
737204

Functional groups

Alkane / alkyl carbon
Amide
Aromatic ring
Nitrile
Secondary amine

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 3'-Cyanoacetanilide
  • 3-Acetamidobenzonitrile
  • 3-Acetaminobenzonitril
  • 58202-84-9
  • AKOS000182292
  • AQ-012/40250408
  • CS-0206331
  • DB-004291
Show all 24 synonyms
  • DTXCID30304260
  • DTXSID30353197
  • EN300-39643
  • F81656
  • ICA20284
  • KXBIARKNAZXRGC-UHFFFAOYSA-N
  • MFCD01047361
  • N-(3-cyanophenyl)acetamide(SALTDATA: FREE)
  • Oprea1_133349
  • PS-4627
  • RefChem:361344
  • SBB087423
  • SCHEMBL171190
  • SCHEMBL30368222
  • SCHEMBL6464794
  • acetamide, N-(3-cyanophenyl)-

Structure identifiers

Canonical SMILES
CC(=O)Nc1cccc(C#N)c1
Isomeric SMILES
CC(=O)NC1=CC=CC(=C1)C#N
InChI
InChI=1S/C9H8N2O/c1-7(12)11-9-4-2-3-8(5-9)6-10/h2-5H,1H3,(H,11,12)
InChIKey
KXBIARKNAZXRGC-UHFFFAOYSA-N
PubChem CID
737204

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for N-(3-cyanophenyl)acetamide; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for N-(3-cyanophenyl)acetamide; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record