2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine

C13H19FN2 — CID 84725143

IUPAC2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine
SMILESNCCc1ccc(C2(F)CCNCC2)cc1
InChIInChI=1S/C13H19FN2/c14-13(6-9-16-10-7-13)12-3-1-11(2-4-12)5-8-15/h1-4,16H,5-10,15H2
InChIKeyXYDLFTDYONLUAA-UHFFFAOYSA-N
MW222.31 g/mol
LogP1.74
Rot. Bonds3

About 2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine

2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine (PubChem CID 84725143) has the molecular formula C13H19FN2 and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine.

Molecular Properties

Compound Name2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine
PubChem CID84725143
Molecular FormulaC13H19FN2
Molecular Weight222.31 g/mol
Exact Mass222.15
IUPAC Name2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine
SMILESNCCc1ccc(C2(F)CCNCC2)cc1
InChIInChI=1S/C13H19FN2/c14-13(6-9-16-10-7-13)12-3-1-11(2-4-12)5-8-15/h1-4,16H,5-10,15H2
InChIKeyXYDLFTDYONLUAA-UHFFFAOYSA-N
XLogP1.74
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-4-(4-fluorophenyl)piperidine;hydrochloride
CID 67540826
(3S)-3-(4-ethylphenyl)-3-fluoropyrrolidine
CID 124547145
(3R)-3-(4-ethylphenyl)-3-fluoropyrrolidine
CID 124547144
4-(4-cyclobutylphenyl)-4-fluoropiperidine
CID 116507136
1-(bromomethyl)-4-(1-fluorocyclopropyl)benzene
CID 165403155
2-[4-(2-aminoethyl)phenyl]ethanamine;hydroiodide
CID 175484243
2-[4-(2-aminoethyl)phenyl]ethanamine;hydrochloride
CID 68536204
4-fluoro-4-(4-phenylphenyl)azepane
CID 103983972
4-fluoro-4-(4-propan-2-ylphenyl)azepane
CID 113361786
1-[3-(4-fluoropiperidin-4-yl)phenyl]propan-2-amine
CID 84727421
[4-(4-chlorophenyl)piperidin-4-yl]methanamine;ethane
CID 143339018
4-fluoro-4-(furan-3-yl)piperidine
CID 112563074

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine?
The IUPAC name of 2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine (CID 84725143) is 2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine.
What is the SMILES notation for 2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine?
The canonical SMILES for 2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine is NCCc1ccc(C2(F)CCNCC2)cc1.
What is the InChIKey of 2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine?
The InChIKey is XYDLFTDYONLUAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2/c14-13(6-9-16-10-7-13)12-3-1-11(2-4-12)5-8-15/h1-4,16H,5-10,15H2.
What are the key properties of 2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine?
2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine has a molecular weight of 222.31 g/mol, XLogP of 1.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-fluoropiperidin-4-yl)phenyl]ethanamine is sourced from PubChem (CID 84725143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).