(4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone

C20H22FNO2 — CID 19746036

IUPAC(4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone
SMILESO=C(c1ccc(F)cc1)C1CCN(C(CO)c2ccccc2)CC1
InChIInChI=1S/C20H22FNO2/c21-18-8-6-16(7-9-18)20(24)17-10-12-22(13-11-17)19(14-23)15-4-2-1-3-5-15/h1-9,17,19,23H,10-14H2
InChIKeyKYOQQMWHYJTAHF-UHFFFAOYSA-N
MW327.40 g/mol
LogP3.45
Rot. Bonds5

About (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone

(4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone (PubChem CID 19746036) has the molecular formula C20H22FNO2 and a molecular weight of 327.40 g/mol. Its IUPAC name is (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone
PubChem CID19746036
Molecular FormulaC20H22FNO2
Molecular Weight327.40 g/mol
Exact Mass327.16
IUPAC Name(4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone
SMILESO=C(c1ccc(F)cc1)C1CCN(C(CO)c2ccccc2)CC1
InChIInChI=1S/C20H22FNO2/c21-18-8-6-16(7-9-18)20(24)17-10-12-22(13-11-17)19(14-23)15-4-2-1-3-5-15/h1-9,17,19,23H,10-14H2
InChIKeyKYOQQMWHYJTAHF-UHFFFAOYSA-N
XLogP3.45
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.40
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone?
The IUPAC name of (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone (CID 19746036) is (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone.
What is the SMILES notation for (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone?
The canonical SMILES for (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone is O=C(c1ccc(F)cc1)C1CCN(C(CO)c2ccccc2)CC1.
What is the InChIKey of (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone?
The InChIKey is KYOQQMWHYJTAHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FNO2/c21-18-8-6-16(7-9-18)20(24)17-10-12-22(13-11-17)19(14-23)15-4-2-1-3-5-15/h1-9,17,19,23H,10-14H2.
What are the key properties of (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone?
(4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone has a molecular weight of 327.40 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[1-(2-hydroxy-1-phenylethyl)piperidin-4-yl]methanone is sourced from PubChem (CID 19746036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).