5-hydroxy-5,5-diphenylpentan-2-one

C17H18O2 — CID 10777335

IUPAC5-hydroxy-5,5-diphenylpentan-2-one
SMILESCC(=O)CCC(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H18O2/c1-14(18)12-13-17(19,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,19H,12-13H2,1H3
InChIKeyCIVNBYZCGOKWGD-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.29
Rot. Bonds5

About 5-hydroxy-5,5-diphenylpentan-2-one

5-hydroxy-5,5-diphenylpentan-2-one (PubChem CID 10777335) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 5-hydroxy-5,5-diphenylpentan-2-one.

Molecular Properties

Compound Name5-hydroxy-5,5-diphenylpentan-2-one
PubChem CID10777335
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name5-hydroxy-5,5-diphenylpentan-2-one
SMILESCC(=O)CCC(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H18O2/c1-14(18)12-13-17(19,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,19H,12-13H2,1H3
InChIKeyCIVNBYZCGOKWGD-UHFFFAOYSA-N
XLogP3.29
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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rel-(1R,2S)-2-Hydroxy-2-phenylcyclohexanecarboxylic acid
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1-Phenylcyclohexanol
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Methyl benzilate
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1,7-Bis(4-Hydroxyphenyl)Heptan-3-One
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1,1-Diphenylethanol
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3-Benzyl-4-hydroxynaphthalene-1,2-dione
CID 263529
Mls002638215
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1,2-Diphenyl-2-propanol
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CID 227383

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-5,5-diphenylpentan-2-one?
The IUPAC name of 5-hydroxy-5,5-diphenylpentan-2-one (CID 10777335) is 5-hydroxy-5,5-diphenylpentan-2-one.
What is the SMILES notation for 5-hydroxy-5,5-diphenylpentan-2-one?
The canonical SMILES for 5-hydroxy-5,5-diphenylpentan-2-one is CC(=O)CCC(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 5-hydroxy-5,5-diphenylpentan-2-one?
The InChIKey is CIVNBYZCGOKWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c1-14(18)12-13-17(19,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,19H,12-13H2,1H3.
What are the key properties of 5-hydroxy-5,5-diphenylpentan-2-one?
5-hydroxy-5,5-diphenylpentan-2-one has a molecular weight of 254.33 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-5,5-diphenylpentan-2-one is sourced from PubChem (CID 10777335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).