Molecular properties
- Formula
- C14H23NO
- Molar mass
- 221.34 g·mol−1
- Exact mass
- 221.1780 Da
- 4
- PubChem CID
- 9838022
Molecule record
3-[(2R,3R)-1-(dimethylamino)-2-methylpentan-3-yl]phenol
C14H23NO
221.34 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Phenol
Tertiary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- (R,R)-Tapentadol
- 175591-23-8
- 3-((1R,2R)-3-(Dimethylamino)-1-ethyl-2-methylpropyl)phenol
- BN 200
- BN 200 (BASE)
- CG-5503
- CG5503
- CG5503 (BASE)
Show all 24 synonyms
- CG5503 IR
- DEA No. 9780
- DTXCID1092494
- DTXSID30170003
- H8A007M585
- HSDB 8309
- NSC-759619
- RefChem:58438
- TAPENTADOL [MI]
- Tapentadol
- Tapentadol (USAN/INN)
- Tapentadol [INN]
- Tapentadol [USAN:INN]
- UNII-H8A007M585
- phenol, 3-[(1r,2r)-3-(dimethylamino)-1-ethyl-2-methylpropyl]-
- tapentadolum
Structure identifiers
- Canonical SMILES
- CC[C@@H](c1cccc(O)c1)[C@@H](C)CN(C)C
- Isomeric SMILES
- CC[C@@H](C1=CC(=CC=C1)O)[C@@H](C)CN(C)C
- InChI
- InChI=1S/C14H23NO/c1-5-14(11(2)10-15(3)4)12-7-6-8-13(16)9-12/h6-9,11,14,16H,5,10H2,1-4H3/t11-,14+/m0/s1
- InChIKey
- KWTWDQCKEHXFFR-SMDDNHRTSA-N
- PubChem CID
- 9838022
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 3-[(2R,3R)-1-(dimethylamino)-2-methylpentan-3-yl]phenol; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-[(2R,3R)-1-(dimethylamino)-2-methylpentan-3-yl]phenol; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.