5-hydroxy-1,3,5-triphenylpentan-1-one

C23H22O2 — CID 11727250

IUPAC5-hydroxy-1,3,5-triphenylpentan-1-one
SMILESO=C(CC(CC(O)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H22O2/c24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(25)20-14-8-3-9-15-20/h1-15,21-22,24H,16-17H2
InChIKeyPRLWQOBAKQAVBH-UHFFFAOYSA-N
MW330.43 g/mol
LogP5.17
Rot. Bonds7

About 5-hydroxy-1,3,5-triphenylpentan-1-one

5-hydroxy-1,3,5-triphenylpentan-1-one (PubChem CID 11727250) has the molecular formula C23H22O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is 5-hydroxy-1,3,5-triphenylpentan-1-one.

Molecular Properties

Compound Name5-hydroxy-1,3,5-triphenylpentan-1-one
PubChem CID11727250
Molecular FormulaC23H22O2
Molecular Weight330.43 g/mol
Exact Mass330.16
IUPAC Name5-hydroxy-1,3,5-triphenylpentan-1-one
SMILESO=C(CC(CC(O)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H22O2/c24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(25)20-14-8-3-9-15-20/h1-15,21-22,24H,16-17H2
InChIKeyPRLWQOBAKQAVBH-UHFFFAOYSA-N
XLogP5.17
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.43
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-1,3-diphenylpentan-1-one
CID 11042799
(3S)-1,3-diphenylhex-5-en-1-one
CID 11288162
(3S)-3-hydroxy-1-phenyl-3-(4-phenylphenyl)propan-1-one
CID 102595151
3-phenyl-1,5-dipyridin-4-ylpentane-1,5-dione
CID 11290437
(3R,5S)-3,5-dihydroxy-1,7-diphenylheptane-1,7-dione
CID 57327357
3-(4-chlorophenyl)-3-hydroxy-1-phenylpropan-1-one
CID 11032650
14-bromo-1,3-diphenyltetradecan-1-one
CID 135391784
7-oxo-5,7-diphenylhept-2-enoic acid
CID 71390061
[(1R)-2-hydroxy-1-phenylethyl] (3S)-5-oxo-3,5-diphenylpentanoate
CID 10318087
(3R)-1,3-diphenyl-3-(4-phenylphenyl)propan-1-one
CID 86338470
(3R)-3-(3-hydroxyphenyl)-1,3-diphenylpropan-1-one
CID 102451950
3-phenacyl-1,5-diphenylpentane-1,5-dione
CID 10547136

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-1,3,5-triphenylpentan-1-one?
The IUPAC name of 5-hydroxy-1,3,5-triphenylpentan-1-one (CID 11727250) is 5-hydroxy-1,3,5-triphenylpentan-1-one.
What is the SMILES notation for 5-hydroxy-1,3,5-triphenylpentan-1-one?
The canonical SMILES for 5-hydroxy-1,3,5-triphenylpentan-1-one is O=C(CC(CC(O)c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of 5-hydroxy-1,3,5-triphenylpentan-1-one?
The InChIKey is PRLWQOBAKQAVBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22O2/c24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(25)20-14-8-3-9-15-20/h1-15,21-22,24H,16-17H2.
What are the key properties of 5-hydroxy-1,3,5-triphenylpentan-1-one?
5-hydroxy-1,3,5-triphenylpentan-1-one has a molecular weight of 330.43 g/mol, XLogP of 5.17, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1,3,5-triphenylpentan-1-one is sourced from PubChem (CID 11727250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).