3-(4-(4-Fluorophenyl)piperidin-1-yl)propan-1-amine
Basic information
- CAS
245046-55-3- Standard SMILES
NCCCN1CCC(c2ccc(F)cc2)CC1- InChIKey
VFMQCWPKRRNFKO-UHFFFAOYSA-N- Molecular formula
- C14H21FN2
- Average molar mass
- 236.33 g/mol
Names & identifiers
- Preferred name
- 3-(4-(4-Fluorophenyl)piperidin-1-yl)propan-1-amine
- IUPAC
- 3-[4-(4-fluorophenyl)piperidin-1-yl]propan-1-amine
- English name
- 1-Piperidinepropanamine, 4-(4-fluorophenyl)-(WXG01504)
- Molecular formula
- C14H21FN2
- Molecular weight
- 236.33
Names & synonyms
3-(4-(4-Fluorophenyl)piperidin-1-yl)propan-1-amine245046-55-3SCHEMBL3595429VFMQCWPKRRNFKO-UHFFFAOYSA-N1-(3-aminopropyl)-4-(4-fluorophenyl)piperidineA1-394953-[4-(4-FLUOROPHENYL)PIPERIDIN-1-YL]PROPYLAMINE1-PIPERIDINEPROPANAMINE, 4-(4-FLUOROPHENYL)-3-[4-(4-Fluoro-phenyl)-piperidin-1-yl]-propylamine1-Piperidinepropanamine, 4-(4-fluorophenyl)-(WXG01504)
Database identifiers
- CAS
245046-55-3
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 206
Physicochemical properties
- Boiling point
- 340 · 340.0±42.0 °C(Predicted)
- Density
- 1.056 · 1.056±0.06 g/cm3(Predicted)
- pka
- 10.44 · 10.44±0.10(Predicted)
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Compound notes
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