(2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one

C20H22FNO — CID 2502673

IUPAC(2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one
SMILESO=C(c1ccc(F)cc1)[C@@H](Cc1ccccc1)N1CCCCC1
InChIInChI=1S/C20H22FNO/c21-18-11-9-17(10-12-18)20(23)19(22-13-5-2-6-14-22)15-16-7-3-1-4-8-16/h1,3-4,7-12,19H,2,5-6,13-15H2/t19-/m1/s1
InChIKeyCNVYIWOLMJXYLZ-LJQANCHMSA-N
MW311.40 g/mol
LogP4.11
Rot. Bonds5

About (2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one

(2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one (PubChem CID 2502673) has the molecular formula C20H22FNO and a molecular weight of 311.40 g/mol. Its IUPAC name is (2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one.

Molecular Properties

Compound Name(2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one
PubChem CID2502673
Molecular FormulaC20H22FNO
Molecular Weight311.40 g/mol
Exact Mass311.17
IUPAC Name(2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one
SMILESO=C(c1ccc(F)cc1)[C@@H](Cc1ccccc1)N1CCCCC1
InChIInChI=1S/C20H22FNO/c21-18-11-9-17(10-12-18)20(23)19(22-13-5-2-6-14-22)15-16-7-3-1-4-8-16/h1,3-4,7-12,19H,2,5-6,13-15H2/t19-/m1/s1
InChIKeyCNVYIWOLMJXYLZ-LJQANCHMSA-N
XLogP4.11
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.40
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one
CID 4317335
1-(4-ethoxyphenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one
CID 5024671
(2R)-2-morpholin-4-yl-1,3-diphenylpropan-1-one
CID 7000195
1-(4-hydroxyphenyl)-2-morpholin-4-yl-3-phenylpropan-1-one
CID 24843920
(2R,7R)-1,8-diphenyl-2,7-di(piperidin-1-yl)octane-1,8-dione
CID 31275145
3-(1H-indol-2-yl)-1-phenyl-2-piperidin-1-ylpropan-1-one
CID 70630041
4-(4-chlorophenyl)-1-(4-fluorophenyl)-4-hydroxy-2-piperidin-1-ylbutan-1-one
CID 23054423
1-(1-benzofuran-2-yl)-3-phenyl-2-piperidin-1-ylpropan-1-one
CID 3530712
methyl 3-phenyl-2-pyrrolidin-1-ylpropanoate
CID 20833938
(2R)-1-(4-fluorophenyl)-2-pyrrolidin-1-yloctan-1-one
CID 125181338
(2S)-1-phenyl-2-pyrrolidin-1-ylpentan-1-one
CID 86310958
1-[1-oxo-3-phenyl-1-[4-(tetrazol-1-yl)phenyl]propan-2-yl]piperidine-4-carboxylic acid
CID 123651406

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one?
The IUPAC name of (2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one (CID 2502673) is (2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one.
What is the SMILES notation for (2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one?
The canonical SMILES for (2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one is O=C(c1ccc(F)cc1)[C@@H](Cc1ccccc1)N1CCCCC1.
What is the InChIKey of (2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one?
The InChIKey is CNVYIWOLMJXYLZ-LJQANCHMSA-N. The full InChI is InChI=1S/C20H22FNO/c21-18-11-9-17(10-12-18)20(23)19(22-13-5-2-6-14-22)15-16-7-3-1-4-8-16/h1,3-4,7-12,19H,2,5-6,13-15H2/t19-/m1/s1.
What are the key properties of (2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one?
(2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one has a molecular weight of 311.40 g/mol, XLogP of 4.11, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(4-fluorophenyl)-3-phenyl-2-piperidin-1-ylpropan-1-one is sourced from PubChem (CID 2502673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).