1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol

C19H22O — CID 114601312

IUPAC1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol
SMILESOC(CCc1ccccc1)c1ccccc1C1CCC1
InChIInChI=1S/C19H22O/c20-19(14-13-15-7-2-1-3-8-15)18-12-5-4-11-17(18)16-9-6-10-16/h1-5,7-8,11-12,16,19-20H,6,9-10,13-14H2
InChIKeyWBTYFRPBSUUFPL-UHFFFAOYSA-N
MW266.38 g/mol
LogP4.62
Rot. Bonds5

About 1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol

1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol (PubChem CID 114601312) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol.

Molecular Properties

Compound Name1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol
PubChem CID114601312
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol
SMILESOC(CCc1ccccc1)c1ccccc1C1CCC1
InChIInChI=1S/C19H22O/c20-19(14-13-15-7-2-1-3-8-15)18-12-5-4-11-17(18)16-9-6-10-16/h1-5,7-8,11-12,16,19-20H,6,9-10,13-14H2
InChIKeyWBTYFRPBSUUFPL-UHFFFAOYSA-N
XLogP4.62
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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1-(2-iodophenyl)-3-phenylpropan-1-ol
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CID 62502803
1-(2-cyclobutylphenyl)butane-1,2-diol
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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol?
The IUPAC name of 1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol (CID 114601312) is 1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol.
What is the SMILES notation for 1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol?
The canonical SMILES for 1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol is OC(CCc1ccccc1)c1ccccc1C1CCC1.
What is the InChIKey of 1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol?
The InChIKey is WBTYFRPBSUUFPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c20-19(14-13-15-7-2-1-3-8-15)18-12-5-4-11-17(18)16-9-6-10-16/h1-5,7-8,11-12,16,19-20H,6,9-10,13-14H2.
What are the key properties of 1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol?
1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol has a molecular weight of 266.38 g/mol, XLogP of 4.62, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol is sourced from PubChem (CID 114601312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).