1-hydroxy-1,5-diphenylpentan-3-one

C17H18O2 — CID 11747173

IUPAC1-hydroxy-1,5-diphenylpentan-3-one
SMILESO=C(CCc1ccccc1)CC(O)c1ccccc1
InChIInChI=1S/C17H18O2/c18-16(12-11-14-7-3-1-4-8-14)13-17(19)15-9-5-2-6-10-15/h1-10,17,19H,11-13H2
InChIKeyUHSJTXLYNITKOY-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.31
Rot. Bonds6

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

1-hydroxy-1,5-diphenylpentan-3-one (PubChem CID 11747173) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-hydroxy-1,5-diphenylpentan-3-one.

Molecular Properties

Compound Name1-hydroxy-1,5-diphenylpentan-3-one
PubChem CID11747173
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name1-hydroxy-1,5-diphenylpentan-3-one
SMILESO=C(CCc1ccccc1)CC(O)c1ccccc1
InChIInChI=1S/C17H18O2/c18-16(12-11-14-7-3-1-4-8-14)13-17(19)15-9-5-2-6-10-15/h1-10,17,19H,11-13H2
InChIKeyUHSJTXLYNITKOY-UHFFFAOYSA-N
XLogP3.31
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 8400
Benzhydrol
CID 7037
(R,R)-Hydrobenzoin
CID 853019
Hydrobenzoin
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1,2-Diphenylethanol
CID 94178
Ethyl 3-phenylhydracrylate, (+-)-
CID 99818
Mls002638215
CID 223673
Dihydroyashabushiketol
CID 10265808
(5S)-5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-one
CID 13347313
5-Methoxy-1,7-diphenyl-3-heptanone
CID 5319430
5-Hydroxy-7-(4-hydroxyphenyl)-1-phenyl-3-heptanone
CID 10040339
2-(Hydroxy-phenylmethyl)cyclopent-2-en-1-one
CID 11030566

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1,5-diphenylpentan-3-one?
The IUPAC name of 1-hydroxy-1,5-diphenylpentan-3-one (CID 11747173) is 1-hydroxy-1,5-diphenylpentan-3-one.
What is the SMILES notation for 1-hydroxy-1,5-diphenylpentan-3-one?
The canonical SMILES for 1-hydroxy-1,5-diphenylpentan-3-one is O=C(CCc1ccccc1)CC(O)c1ccccc1.
What is the InChIKey of 1-hydroxy-1,5-diphenylpentan-3-one?
The InChIKey is UHSJTXLYNITKOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c18-16(12-11-14-7-3-1-4-8-14)13-17(19)15-9-5-2-6-10-15/h1-10,17,19H,11-13H2.
What are the key properties of 1-hydroxy-1,5-diphenylpentan-3-one?
1-hydroxy-1,5-diphenylpentan-3-one has a molecular weight of 254.33 g/mol, XLogP of 3.31, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1,5-diphenylpentan-3-one is sourced from PubChem (CID 11747173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).