(R)-N-(2-oxo-2-(pyrrolidin-3-ylamino)ethyl)-3-(trifluoromethyl)benzamide
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Basic information
- CAS
226249-16-7- Standard SMILES
O=C(CNC(=O)c1cccc(C(F)(F)F)c1)N[C@@H]1CCNC1- InChIKey
HPILSJVIWVODDZ-LLVKDONJSA-N- Molecular formula
- C14H16F3N3O2
- Average molar mass
- 315.29 g/mol
Names & identifiers
- Preferred name
- (R)-N-(2-oxo-2-(pyrrolidin-3-ylamino)ethyl)-3-(trifluoromethyl)benzamide
- IUPAC
- N-[2-oxo-2-[[(3R)-pyrrolidin-3-yl]amino]ethyl]-3-(trifluoromethyl)benzamide
- English name
- (R)-N-(2-oxo-2-(pyrrolidin-3-ylaMino)-ethyl)-3-(trifluoroMethyl)benzaMide
- Molecular formula
- C14H16F3N3O2
- Molecular weight
- 315.29
Names & synonyms
226249-16-7(R)-N-(2-oxo-2-(pyrrolidin-3-ylamino)ethyl)-3-(trifluoromethyl)benzamide(R)-N-(2-oxo-2-(pyrrolidin-3-ylaMino)-ethyl)-3-(trifluoroMethyl)benzaMideN-[2-oxo-2-[[(3R)-pyrrolidin-3-yl]amino]ethyl]-3-(trifluoromethyl)benzamideBenzamide, N-[2-oxo-2-[(3R)-3-pyrrolidinylamino]ethyl]-3-(trifluoromethyl)-(R)-3-[N-(3-(trifluoromethyl)benzoyl)glycyl]aminopyrrolidine(R)-3-[N-[3-(trifluoromethyl)benzoyl]glycyl]aminopyrrolidine(R)-3-[N-{3-(trifluoromethyl)benzoyl}glycyl]aminopyrrolidineSCHEMBL744023CS-M3181MFCD29472323AKOS037650524
Show more names
N-(pyrrolidine-(3R)-yl-carbamoylmethyl)-3-trifluoromethylbenzamide
CS-14925DB-328023C12885F790091N- ((R)-Pyrrolidin-3-ylcarbamoylmethyl)-3-trifluoromethyl-benzamideN-((3R)-pyrrolidin -3-ylcarbamoylmethyl)-3-trifluoromethylbenzamideN-((3R)-pyrrolidin-3-ylcarbamoylmethyl)-3-trifluoromethylbenzamideN-((R)-pyrrolidin-3-ylcarbamoylmethyl)-3-trifluoromethyl-benzamide
Database identifiers
- CAS
226249-16-7
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 415
Physicochemical properties
- Boiling point
- 518.9 · 518.9±50.0 °C(Predicted)
- Density
- 1.33 · 1.33±0.1 g/cm3(Predicted)
- pka
- 12.94 · 12.94±0.46(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
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Compound notes
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