1-phenyl-3-phenylmethoxycyclobutan-1-ol

C17H18O2 — CID 135138338

IUPAC1-phenyl-3-phenylmethoxycyclobutan-1-ol
SMILESOC1(c2ccccc2)CC(OCc2ccccc2)C1
InChIInChI=1S/C17H18O2/c18-17(15-9-5-2-6-10-15)11-16(12-17)19-13-14-7-3-1-4-8-14/h1-10,16,18H,11-13H2
InChIKeyOHVLIPYCPLOWIY-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.25
Rot. Bonds4

About 1-phenyl-3-phenylmethoxycyclobutan-1-ol

1-phenyl-3-phenylmethoxycyclobutan-1-ol (PubChem CID 135138338) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-phenyl-3-phenylmethoxycyclobutan-1-ol.

Molecular Properties

Compound Name1-phenyl-3-phenylmethoxycyclobutan-1-ol
PubChem CID135138338
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name1-phenyl-3-phenylmethoxycyclobutan-1-ol
SMILESOC1(c2ccccc2)CC(OCc2ccccc2)C1
InChIInChI=1S/C17H18O2/c18-17(15-9-5-2-6-10-15)11-16(12-17)19-13-14-7-3-1-4-8-14/h1-10,16,18H,11-13H2
InChIKeyOHVLIPYCPLOWIY-UHFFFAOYSA-N
XLogP3.25
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenylmethoxycyclobutane-1,1-diol
CID 170382479
1-hydroxy-3-phenylmethoxycyclobutane-1-carboxylic acid
CID 149153047
(1-amino-3-phenylmethoxycyclobutyl)methanol;hydrochloride
CID 121282495
cis-(1R,4S)-1,2,2-trimethyl-4-phenylmethoxycyclopentane-1-carboxylic acid
CID 10706618
1-methoxy-3-phenylmethoxycyclobutan-1-amine
CID 174783197
2-methyl-1-phenyl-3-phenylmethoxycyclobutan-1-ol
CID 172787553
[2,3,4,5,6-pentakis(phenylmethoxy)cyclohexyl]oxymethylbenzene
CID 10747453
[(1R,2R)-2-methyl-2-phenylcyclopropyl]oxymethylbenzene
CID 100970284
1-(aminomethyl)-4-phenylmethoxycyclohexan-1-ol;hydrochloride
CID 69471607
azane;cyclopentyloxymethylbenzene
CID 69411306
1-(1-methoxyethenyl)-3-phenylmethoxycyclobutane-1-carboxylic acid
CID 163720538
(3-chlorocyclobutyl)oxymethylbenzene
CID 66344030

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-3-phenylmethoxycyclobutan-1-ol?
The IUPAC name of 1-phenyl-3-phenylmethoxycyclobutan-1-ol (CID 135138338) is 1-phenyl-3-phenylmethoxycyclobutan-1-ol.
What is the SMILES notation for 1-phenyl-3-phenylmethoxycyclobutan-1-ol?
The canonical SMILES for 1-phenyl-3-phenylmethoxycyclobutan-1-ol is OC1(c2ccccc2)CC(OCc2ccccc2)C1.
What is the InChIKey of 1-phenyl-3-phenylmethoxycyclobutan-1-ol?
The InChIKey is OHVLIPYCPLOWIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c18-17(15-9-5-2-6-10-15)11-16(12-17)19-13-14-7-3-1-4-8-14/h1-10,16,18H,11-13H2.
What are the key properties of 1-phenyl-3-phenylmethoxycyclobutan-1-ol?
1-phenyl-3-phenylmethoxycyclobutan-1-ol has a molecular weight of 254.33 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-3-phenylmethoxycyclobutan-1-ol is sourced from PubChem (CID 135138338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).