3-cyclohexyloxy-2-propoxycyclobutan-1-ol

C13H24O3 — CID 107942480

IUPAC3-cyclohexyloxy-2-propoxycyclobutan-1-ol
SMILESCCCOC1C(O)CC1OC1CCCCC1
InChIInChI=1S/C13H24O3/c1-2-8-15-13-11(14)9-12(13)16-10-6-4-3-5-7-10/h10-14H,2-9H2,1H3
InChIKeyGFWGYXPIBMBZJS-UHFFFAOYSA-N
MW228.33 g/mol
LogP2.26
Rot. Bonds5

About 3-cyclohexyloxy-2-propoxycyclobutan-1-ol

3-cyclohexyloxy-2-propoxycyclobutan-1-ol (PubChem CID 107942480) has the molecular formula C13H24O3 and a molecular weight of 228.33 g/mol. Its IUPAC name is 3-cyclohexyloxy-2-propoxycyclobutan-1-ol.

Molecular Properties

Compound Name3-cyclohexyloxy-2-propoxycyclobutan-1-ol
PubChem CID107942480
Molecular FormulaC13H24O3
Molecular Weight228.33 g/mol
Exact Mass228.17
IUPAC Name3-cyclohexyloxy-2-propoxycyclobutan-1-ol
SMILESCCCOC1C(O)CC1OC1CCCCC1
InChIInChI=1S/C13H24O3/c1-2-8-15-13-11(14)9-12(13)16-10-6-4-3-5-7-10/h10-14H,2-9H2,1H3
InChIKeyGFWGYXPIBMBZJS-UHFFFAOYSA-N
XLogP2.26
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.33
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclohexyloxy-2-methoxycyclobutan-1-ol
CID 104673596
propoxycyclooctane
CID 54078990
2-propoxy-3-(2-propoxyethoxy)cyclobutan-1-ol
CID 107942594
3-[(2-methylpropan-2-yl)oxy]-2-propoxycyclobutan-1-ol
CID 107942520
2-propoxycyclopropan-1-ol
CID 174614862
3-cyclopentyloxy-2-ethoxycyclobutan-1-amine
CID 104676119
3-(2,2-difluoroethoxy)-2-propoxycyclobutan-1-ol
CID 107942627
3-(3-methylbutan-2-yloxy)-2-propoxycyclobutan-1-ol
CID 107942618
cis-(1S,2R)-2-cyclohexyloxycyclohexan-1-ol
CID 92950752
2-ethoxy-3-(oxolan-3-yloxy)cyclobutan-1-ol
CID 104675429
2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol
CID 107942629
trans-(1R,2R)-2-cyclohexyloxycyclopentan-1-ol
CID 131704149

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyloxy-2-propoxycyclobutan-1-ol?
The IUPAC name of 3-cyclohexyloxy-2-propoxycyclobutan-1-ol (CID 107942480) is 3-cyclohexyloxy-2-propoxycyclobutan-1-ol.
What is the SMILES notation for 3-cyclohexyloxy-2-propoxycyclobutan-1-ol?
The canonical SMILES for 3-cyclohexyloxy-2-propoxycyclobutan-1-ol is CCCOC1C(O)CC1OC1CCCCC1.
What is the InChIKey of 3-cyclohexyloxy-2-propoxycyclobutan-1-ol?
The InChIKey is GFWGYXPIBMBZJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O3/c1-2-8-15-13-11(14)9-12(13)16-10-6-4-3-5-7-10/h10-14H,2-9H2,1H3.
What are the key properties of 3-cyclohexyloxy-2-propoxycyclobutan-1-ol?
3-cyclohexyloxy-2-propoxycyclobutan-1-ol has a molecular weight of 228.33 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyloxy-2-propoxycyclobutan-1-ol is sourced from PubChem (CID 107942480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).