1-(4-cyclobutyloxyphenyl)propan-2-ol

C13H18O2 — CID 117295049

IUPAC1-(4-cyclobutyloxyphenyl)propan-2-ol
SMILESCC(O)Cc1ccc(OC2CCC2)cc1
InChIInChI=1S/C13H18O2/c1-10(14)9-11-5-7-13(8-6-11)15-12-3-2-4-12/h5-8,10,12,14H,2-4,9H2,1H3
InChIKeyHFNOWTQRRDMVNE-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.54
Rot. Bonds4

About 1-(4-cyclobutyloxyphenyl)propan-2-ol

1-(4-cyclobutyloxyphenyl)propan-2-ol (PubChem CID 117295049) has the molecular formula C13H18O2 and a molecular weight of 206.29 g/mol. Its IUPAC name is 1-(4-cyclobutyloxyphenyl)propan-2-ol.

Molecular Properties

Compound Name1-(4-cyclobutyloxyphenyl)propan-2-ol
PubChem CID117295049
Molecular FormulaC13H18O2
Molecular Weight206.29 g/mol
Exact Mass206.13
IUPAC Name1-(4-cyclobutyloxyphenyl)propan-2-ol
SMILESCC(O)Cc1ccc(OC2CCC2)cc1
InChIInChI=1S/C13H18O2/c1-10(14)9-11-5-7-13(8-6-11)15-12-3-2-4-12/h5-8,10,12,14H,2-4,9H2,1H3
InChIKeyHFNOWTQRRDMVNE-UHFFFAOYSA-N
XLogP2.54
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-cyclopentyloxyphenyl)propan-2-ol
CID 80502782
1-[4-(1,1-dioxothiolan-3-yl)oxyphenyl]propan-2-ol
CID 113323142
1-[(4-cyclopentyloxyphenyl)methylamino]propan-2-ol
CID 112513393
1-(4-cyclopropyloxyphenyl)-2-(4-methoxyphenyl)ethanol
CID 114519008
1-(3-chloro-4-cyclopentyloxyphenyl)propan-2-ol
CID 115005691
3-[4-(2-hydroxypropyl)phenoxy]oxolan-2-one
CID 115496011
1-cyclobutyloxy-4-propylbenzene
CID 178141621
4-(4-cyclopentyloxyphenyl)butan-2-amine
CID 16782847
(3R)-3-[4-(2-methylpropyl)phenoxy]oxane
CID 178142322
[4-[3-[4-(hydroxymethyl)phenoxy]cyclohexyl]oxyphenyl]methanol
CID 118229827
2-(4-cyclopentyloxyphenyl)acetamide
CID 82493829
4-[4-(2-hydroxypropyl)phenoxy]-1,1-dioxothiolan-3-ol
CID 115495876

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclobutyloxyphenyl)propan-2-ol?
The IUPAC name of 1-(4-cyclobutyloxyphenyl)propan-2-ol (CID 117295049) is 1-(4-cyclobutyloxyphenyl)propan-2-ol.
What is the SMILES notation for 1-(4-cyclobutyloxyphenyl)propan-2-ol?
The canonical SMILES for 1-(4-cyclobutyloxyphenyl)propan-2-ol is CC(O)Cc1ccc(OC2CCC2)cc1.
What is the InChIKey of 1-(4-cyclobutyloxyphenyl)propan-2-ol?
The InChIKey is HFNOWTQRRDMVNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-10(14)9-11-5-7-13(8-6-11)15-12-3-2-4-12/h5-8,10,12,14H,2-4,9H2,1H3.
What are the key properties of 1-(4-cyclobutyloxyphenyl)propan-2-ol?
1-(4-cyclobutyloxyphenyl)propan-2-ol has a molecular weight of 206.29 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclobutyloxyphenyl)propan-2-ol is sourced from PubChem (CID 117295049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).