3-(3-cyclobutyloxyphenyl)propan-1-ol

C13H18O2 — CID 117294966

IUPAC3-(3-cyclobutyloxyphenyl)propan-1-ol
SMILESOCCCc1cccc(OC2CCC2)c1
InChIInChI=1S/C13H18O2/c14-9-3-5-11-4-1-8-13(10-11)15-12-6-2-7-12/h1,4,8,10,12,14H,2-3,5-7,9H2
InChIKeyWPDVERQMWSRFIK-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.54
Rot. Bonds5

About 3-(3-cyclobutyloxyphenyl)propan-1-ol

3-(3-cyclobutyloxyphenyl)propan-1-ol (PubChem CID 117294966) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 3-(3-cyclobutyloxyphenyl)propan-1-ol.

Molecular Properties

Compound Name3-(3-cyclobutyloxyphenyl)propan-1-ol
PubChem CID117294966
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name3-(3-cyclobutyloxyphenyl)propan-1-ol
SMILESOCCCc1cccc(OC2CCC2)c1
InChIInChI=1S/C13H18O2/c14-9-3-5-11-4-1-8-13(10-11)15-12-6-2-7-12/h1,4,8,10,12,14H,2-3,5-7,9H2
InChIKeyWPDVERQMWSRFIK-UHFFFAOYSA-N
XLogP2.54
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-cyclobutyloxyphenyl)propan-1-amine
CID 117294096
3-[3-(oxolan-3-yloxy)phenyl]propan-1-ol
CID 117318293
(3-cyclopropyloxyphenyl)methanol
CID 57336629
2-(3-cyclopentyloxyphenyl)ethanamine;hydrochloride
CID 155896532
(3-ethylphenoxy)cyclooctane
CID 91220327
4-[3-(oxan-3-yloxy)phenyl]butanoic acid
CID 117415298
2-[1-[(3-cyclopentyloxyphenyl)methyl]pyrrolidin-2-yl]ethanol
CID 74247164
1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one
CID 114522899
6-(3-phenoxyphenyl)hexan-1-ol
CID 70473652
3-[3-(trifluoromethoxy)phenyl]propan-1-ol
CID 53434391
2-[(3-cyclopentyloxyphenyl)methylamino]-2-phenylethanol
CID 111421775
N-[(3-cycloheptyloxyphenyl)methyl]cyclopropanamine
CID 82927729

Frequently Asked Questions

What is the IUPAC name of 3-(3-cyclobutyloxyphenyl)propan-1-ol?
The IUPAC name of 3-(3-cyclobutyloxyphenyl)propan-1-ol (CID 117294966) is 3-(3-cyclobutyloxyphenyl)propan-1-ol.
What is the SMILES notation for 3-(3-cyclobutyloxyphenyl)propan-1-ol?
The canonical SMILES for 3-(3-cyclobutyloxyphenyl)propan-1-ol is OCCCc1cccc(OC2CCC2)c1.
What is the InChIKey of 3-(3-cyclobutyloxyphenyl)propan-1-ol?
The InChIKey is WPDVERQMWSRFIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c14-9-3-5-11-4-1-8-13(10-11)15-12-6-2-7-12/h1,4,8,10,12,14H,2-3,5-7,9H2.
What are the key properties of 3-(3-cyclobutyloxyphenyl)propan-1-ol?
3-(3-cyclobutyloxyphenyl)propan-1-ol has a molecular weight of 206.28 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyclobutyloxyphenyl)propan-1-ol is sourced from PubChem (CID 117294966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).