(4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone

C18H18FNO3 — CID 11609363

IUPAC(4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone
SMILESO=C(c1ccc(F)cc1)N1CCCC(O)(c2cccc(O)c2)C1
InChIInChI=1S/C18H18FNO3/c19-15-7-5-13(6-8-15)17(22)20-10-2-9-18(23,12-20)14-3-1-4-16(21)11-14/h1,3-8,11,21,23H,2,9-10,12H2
InChIKeyKDJLWQXFQWJHLW-UHFFFAOYSA-N
MW315.34 g/mol
LogP2.66
Rot. Bonds2

About (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone

(4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone (PubChem CID 11609363) has the molecular formula C18H18FNO3 and a molecular weight of 315.34 g/mol. Its IUPAC name is (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone
PubChem CID11609363
Molecular FormulaC18H18FNO3
Molecular Weight315.34 g/mol
Exact Mass315.13
IUPAC Name(4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone
SMILESO=C(c1ccc(F)cc1)N1CCCC(O)(c2cccc(O)c2)C1
InChIInChI=1S/C18H18FNO3/c19-15-7-5-13(6-8-15)17(22)20-10-2-9-18(23,12-20)14-3-1-4-16(21)11-14/h1,3-8,11,21,23H,2,9-10,12H2
InChIKeyKDJLWQXFQWJHLW-UHFFFAOYSA-N
XLogP2.66
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.34
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-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

Related Compounds

(4-tert-butylphenyl)-(3-hydroxy-3-phenylpiperidin-1-yl)methanone
CID 10664700
(4-chloro-3-nitrophenyl)-[3-hydroxy-3-(3-methoxyphenyl)piperidin-1-yl]methanone
CID 11646803
[3-(4-fluorophenyl)-3-hydroxypyrrolidin-1-yl]-indolizin-2-ylmethanone
CID 154798734
(3R)-1-(4-fluorobenzoyl)-N-[(3-fluorophenyl)methyl]-3-methylpiperidine-3-carboxamide
CID 95087682
1-(4-fluorobenzoyl)-N-[(3-fluorophenyl)methyl]-3-methylpiperidine-3-carboxamide
CID 53117206
(4-fluorophenyl)-[4-(1-phenylcyclobutanecarbonyl)piperazin-1-yl]methanone
CID 36509634
(4-fluorophenyl)-(1,4-oxazepan-4-yl)methanone
CID 62060048
3-[3-(4-fluorophenyl)-3-hydroxypyrrolidine-1-carbonyl]-5,6,7,8-tetrahydro-1H-quinolin-2-one
CID 167748261
[3-(hydroxymethyl)-3-(2-methylpropyl)piperidin-1-yl]-[4-(3-hydroxyphenyl)phenyl]methanone
CID 119065409
4-(4-fluorobenzoyl)-1,4-diazepane-1-carboxylic acid
CID 67493364
1-(4-fluorobenzoyl)-N-methyl-3-pyrazol-1-ylpiperidine-3-carboxamide
CID 155879215
1'-[4-(4-fluorophenyl)benzoyl]spiro[2-benzofuran-3,3'-piperidine]-1-one
CID 121142434

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone?
The IUPAC name of (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone (CID 11609363) is (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone.
What is the SMILES notation for (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone?
The canonical SMILES for (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone is O=C(c1ccc(F)cc1)N1CCCC(O)(c2cccc(O)c2)C1.
What is the InChIKey of (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone?
The InChIKey is KDJLWQXFQWJHLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FNO3/c19-15-7-5-13(6-8-15)17(22)20-10-2-9-18(23,12-20)14-3-1-4-16(21)11-14/h1,3-8,11,21,23H,2,9-10,12H2.
What are the key properties of (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone?
(4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone has a molecular weight of 315.34 g/mol, XLogP of 2.66, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[3-hydroxy-3-(3-hydroxyphenyl)piperidin-1-yl]methanone is sourced from PubChem (CID 11609363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).