1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one

C15H20O2 — CID 174983482

IUPAC1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one
SMILESCC(=O)C(O)c1ccccc1C1CCCCC1
InChIInChI=1S/C15H20O2/c1-11(16)15(17)14-10-6-5-9-13(14)12-7-3-2-4-8-12/h5-6,9-10,12,15,17H,2-4,7-8H2,1H3
InChIKeyLTPZSRBXNIGJQV-UHFFFAOYSA-N
MW232.32 g/mol
LogP3.36
Rot. Bonds3

About 1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one

1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one (PubChem CID 174983482) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one.

Molecular Properties

Compound Name1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one
PubChem CID174983482
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one
SMILESCC(=O)C(O)c1ccccc1C1CCCCC1
InChIInChI=1S/C15H20O2/c1-11(16)15(17)14-10-6-5-9-13(14)12-7-3-2-4-8-12/h5-6,9-10,12,15,17H,2-4,7-8H2,1H3
InChIKeyLTPZSRBXNIGJQV-UHFFFAOYSA-N
XLogP3.36
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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(2R)-2-(2-cyclopentylphenyl)-2-hydroxyacetaldehyde
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(1,1-dimethylpyrrolidin-1-ium-2-yl) 2-(2-cyclopentylphenyl)-2-hydroxyacetate
CID 142745525
ethyl 2-hydroxy-2-[2-(1-methylazepan-4-yl)phenyl]acetate
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1-(3-chlorobutan-2-yl)-2-cyclobutylbenzene
CID 114605798
1-(2-cyclopentylphenyl)propan-2-one
CID 83832084
1-(2-cyclobutylphenyl)butane-1,2-diol
CID 103454593
ethyl 2-[1-[(2R)-2-(2-cyclopentylphenyl)-2-hydroxyacetyl]oxypyrrolidin-1-ium-1-yl]propanoate bromide
CID 118365534
2-(cyclohexylamino)-2-(2-cyclopropylphenyl)acetic acid
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methyl 2-(2-cyclobutylphenyl)-3-methylbutanoate
CID 114605730

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one?
The IUPAC name of 1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one (CID 174983482) is 1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one.
What is the SMILES notation for 1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one?
The canonical SMILES for 1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one is CC(=O)C(O)c1ccccc1C1CCCCC1.
What is the InChIKey of 1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one?
The InChIKey is LTPZSRBXNIGJQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c1-11(16)15(17)14-10-6-5-9-13(14)12-7-3-2-4-8-12/h5-6,9-10,12,15,17H,2-4,7-8H2,1H3.
What are the key properties of 1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one?
1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one has a molecular weight of 232.32 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylphenyl)-1-hydroxypropan-2-one is sourced from PubChem (CID 174983482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).