[3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone

C24H23NO3 — CID 74250458

IUPAC[3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone
SMILESO=C(c1cccc(-c2ccc(O)cc2)c1)N1CCC(O)(c2ccccc2)CC1
InChIInChI=1S/C24H23NO3/c26-22-11-9-18(10-12-22)19-5-4-6-20(17-19)23(27)25-15-13-24(28,14-16-25)21-7-2-1-3-8-21/h1-12,17,26,28H,13-16H2
InChIKeyMESLPBQHERMASR-UHFFFAOYSA-N
MW373.45 g/mol
LogP4.18
Rot. Bonds3

About [3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone

[3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone (PubChem CID 74250458) has the molecular formula C24H23NO3 and a molecular weight of 373.45 g/mol. Its IUPAC name is [3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone
PubChem CID74250458
Molecular FormulaC24H23NO3
Molecular Weight373.45 g/mol
Exact Mass373.17
IUPAC Name[3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone
SMILESO=C(c1cccc(-c2ccc(O)cc2)c1)N1CCC(O)(c2ccccc2)CC1
InChIInChI=1S/C24H23NO3/c26-22-11-9-18(10-12-22)19-5-4-6-20(17-19)23(27)25-15-13-24(28,14-16-25)21-7-2-1-3-8-21/h1-12,17,26,28H,13-16H2
InChIKeyMESLPBQHERMASR-UHFFFAOYSA-N
XLogP4.18
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.45
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(4-hydroxyphenyl)phenyl]-morpholin-4-ylmethanone
CID 2428040
1-[4-(3-phenylbenzoyl)piperazin-1-yl]ethanone
CID 110755413
[4-(4-fluorophenyl)piperazin-1-yl]-[3-(4-hydroxyphenyl)phenyl]methanone
CID 2106289
(3-fluorophenyl)-[4-(3-phenylbenzoyl)piperazin-1-yl]methanone
CID 110365297
(1-oxo-1,4-thiazinan-4-yl)-(3-phenylphenyl)methanone
CID 110721543
[3-(3-hydroxyphenyl)phenyl]-pyrrolidin-1-ylmethanone
CID 53218719
[3-(4-fluorophenyl)phenyl]-[(4S)-4-hydroxy-4-(hydroxymethyl)azepan-1-yl]methanone
CID 95707324
1-benzoyl-4-phenylpiperidine-4-carboxylic acid
CID 22240952
1-(3-chlorobenzoyl)-4-phenylpiperidine-4-carboxylic acid
CID 45433186
(4-hydroxy-4-methylpiperidin-1-yl)-(3-hydroxyphenyl)methanone
CID 81097779
azepan-1-yl-[3-(4-methylphenyl)phenyl]methanone
CID 126484488
2-[4-hydroxy-4-(4-phenylphenyl)piperidin-1-yl]-1-phenylethanone
CID 23383913

Frequently Asked Questions

What is the IUPAC name of [3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone?
The IUPAC name of [3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone (CID 74250458) is [3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone.
What is the SMILES notation for [3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone?
The canonical SMILES for [3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone is O=C(c1cccc(-c2ccc(O)cc2)c1)N1CCC(O)(c2ccccc2)CC1.
What is the InChIKey of [3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone?
The InChIKey is MESLPBQHERMASR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO3/c26-22-11-9-18(10-12-22)19-5-4-6-20(17-19)23(27)25-15-13-24(28,14-16-25)21-7-2-1-3-8-21/h1-12,17,26,28H,13-16H2.
What are the key properties of [3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone?
[3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone has a molecular weight of 373.45 g/mol, XLogP of 4.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-hydroxyphenyl)phenyl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone is sourced from PubChem (CID 74250458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).