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

C17H18O2 — CID 14469744

IUPAC2-hydroxy-1,5-diphenylpentan-3-one
SMILESO=C(CCc1ccccc1)C(O)Cc1ccccc1
InChIInChI=1S/C17H18O2/c18-16(12-11-14-7-3-1-4-8-14)17(19)13-15-9-5-2-6-10-15/h1-10,17,19H,11-13H2
InChIKeyRHYFFNVUZXSTRZ-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.79
Rot. Bonds6

About 2-hydroxy-1,5-diphenylpentan-3-one

2-hydroxy-1,5-diphenylpentan-3-one (PubChem CID 14469744) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-hydroxy-1,5-diphenylpentan-3-one.

Molecular Properties

Compound Name2-hydroxy-1,5-diphenylpentan-3-one
PubChem CID14469744
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name2-hydroxy-1,5-diphenylpentan-3-one
SMILESO=C(CCc1ccccc1)C(O)Cc1ccccc1
InChIInChI=1S/C17H18O2/c18-16(12-11-14-7-3-1-4-8-14)17(19)13-15-9-5-2-6-10-15/h1-10,17,19H,11-13H2
InChIKeyRHYFFNVUZXSTRZ-UHFFFAOYSA-N
XLogP2.79
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 ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-hydroxy-1-phenylhexan-3-one
CID 103453087
(2R)-2-hydroxy-3-phenylpropanoic acid;hydrochloride
CID 67010378
2-methoxy-1,5-diphenylpentan-3-one
CID 50994790
lanthanum;3-phenylpropanoic acid
CID 174887955
sodium;hydride;2-hydroxy-3-phenylpropanoic acid
CID 173185606
(2S)-2-hydroxy-3-phenylpropanethioic S-acid
CID 21114760
4-bromo-1-phenylpentan-3-one
CID 121216753
4-ethyl-1-phenylhexan-3-one
CID 71072308
4-hydroxy-1-phenyl-7-phenylmethoxyheptan-3-one
CID 135012446
3-[4-(2-phenylethyl)phenyl]propanoic acid
CID 54586982
(2R)-3-(4-benzylphenyl)-2-hydroxypropanoic acid
CID 150376143
3-hydroxy-1-phenylnonan-4-one
CID 135039078

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1,5-diphenylpentan-3-one?
The IUPAC name of 2-hydroxy-1,5-diphenylpentan-3-one (CID 14469744) is 2-hydroxy-1,5-diphenylpentan-3-one.
What is the SMILES notation for 2-hydroxy-1,5-diphenylpentan-3-one?
The canonical SMILES for 2-hydroxy-1,5-diphenylpentan-3-one is O=C(CCc1ccccc1)C(O)Cc1ccccc1.
What is the InChIKey of 2-hydroxy-1,5-diphenylpentan-3-one?
The InChIKey is RHYFFNVUZXSTRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c18-16(12-11-14-7-3-1-4-8-14)17(19)13-15-9-5-2-6-10-15/h1-10,17,19H,11-13H2.
What are the key properties of 2-hydroxy-1,5-diphenylpentan-3-one?
2-hydroxy-1,5-diphenylpentan-3-one has a molecular weight of 254.33 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1,5-diphenylpentan-3-one is sourced from PubChem (CID 14469744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).