(2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride

C11H15ClFN — CID 167716918

IUPAC(2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride
SMILESCl.F[C@H]1CCCN[C@H]1c1ccccc1
InChIInChI=1S/C11H14FN.ClH/c12-10-7-4-8-13-11(10)9-5-2-1-3-6-9;/h1-3,5-6,10-11,13H,4,7-8H2;1H/t10-,11-;/m0./s1
InChIKeyBFBBJLUCKJSYNU-ACMTZBLWSA-N
MW215.70 g/mol
LogP2.87
Rot. Bonds1

About (2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride

(2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride (PubChem CID 167716918) has the molecular formula C11H15ClFN and a molecular weight of 215.70 g/mol. Its IUPAC name is (2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride.

Molecular Properties

Compound Name(2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride
PubChem CID167716918
Molecular FormulaC11H15ClFN
Molecular Weight215.70 g/mol
Exact Mass215.09
IUPAC Name(2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride
SMILESCl.F[C@H]1CCCN[C@H]1c1ccccc1
InChIInChI=1S/C11H14FN.ClH/c12-10-7-4-8-13-11(10)9-5-2-1-3-6-9;/h1-3,5-6,10-11,13H,4,7-8H2;1H/t10-,11-;/m0./s1
InChIKeyBFBBJLUCKJSYNU-ACMTZBLWSA-N
XLogP2.87
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.70
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S,3S)-3-fluoro-2-phenylpiperidine
CID 167716919
3-fluoro-2-(4-fluorophenyl)piperidine;hydrochloride
CID 115039873
2-phenylpiperidin-3-ol
CID 18782643
(2S,3S)-2-phenyl-3-(trifluoromethyl)piperidine
CID 95374690
[(2R,3R)-2-phenylpiperidin-3-yl]azanium
CID 59904937
(3R)-3-methyl-2-phenylpiperidine
CID 155222992
(2S,3R)-2-phenylpiperidin-3-amine
CID 56845355
2,3-diphenylpiperazine;hydrochloride
CID 175072756
(2S,3S)-3-fluoro-2-phenylazetidine
CID 118903296
(2S,3R)-3-phenoxy-2-phenylpiperidine
CID 97356138
2-phenylpiperidine-3-carbaldehyde
CID 174613861
(2S,3S)-N-benzyl-2-phenylpiperidin-3-amine
CID 67754429

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride?
The IUPAC name of (2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride (CID 167716918) is (2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride.
What is the SMILES notation for (2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride?
The canonical SMILES for (2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride is Cl.F[C@H]1CCCN[C@H]1c1ccccc1.
What is the InChIKey of (2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride?
The InChIKey is BFBBJLUCKJSYNU-ACMTZBLWSA-N. The full InChI is InChI=1S/C11H14FN.ClH/c12-10-7-4-8-13-11(10)9-5-2-1-3-6-9;/h1-3,5-6,10-11,13H,4,7-8H2;1H/t10-,11-;/m0./s1.
What are the key properties of (2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride?
(2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride has a molecular weight of 215.70 g/mol, XLogP of 2.87, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-3-fluoro-2-phenylpiperidine;hydrochloride is sourced from PubChem (CID 167716918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).