1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane

C18H34O3 — CID 139806384

IUPAC1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane
SMILESCC(COC1CCCCC1)OCC(C)OC1CCCCC1
InChIInChI=1S/C18H34O3/c1-15(13-20-17-9-5-3-6-10-17)19-14-16(2)21-18-11-7-4-8-12-18/h15-18H,3-14H2,1-2H3
InChIKeyXWFYBGDLYBPFIO-UHFFFAOYSA-N
MW298.47 g/mol
LogP4.48
Rot. Bonds8

About 1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane

1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane (PubChem CID 139806384) has the molecular formula C18H34O3 and a molecular weight of 298.47 g/mol. Its IUPAC name is 1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane.

Molecular Properties

Compound Name1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane
PubChem CID139806384
Molecular FormulaC18H34O3
Molecular Weight298.47 g/mol
Exact Mass298.25
IUPAC Name1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane
SMILESCC(COC1CCCCC1)OCC(C)OC1CCCCC1
InChIInChI=1S/C18H34O3/c1-15(13-20-17-9-5-3-6-10-17)19-14-16(2)21-18-11-7-4-8-12-18/h15-18H,3-14H2,1-2H3
InChIKeyXWFYBGDLYBPFIO-UHFFFAOYSA-N
XLogP4.48
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclododecyloxypropan-2-ol
CID 54403914
bis(2-cyclohexyloxypropyl) hydrogen phosphate
CID 140502091
propan-2-yloxymethoxycyclononane
CID 21496351
N-(2-cycloheptyloxypropyl)cyclopropanamine
CID 62460037
propan-2-yloxycycloundecane
CID 91254526
[(2S)-1-cyclopentyloxypropan-2-yl] (2S)-2-aminopropanoate
CID 121466308
3-cyclopentyloxy-2-methylpropan-1-amine
CID 43367941
3-cycloheptyloxy-2-methylpropanimidamide
CID 114995552
(2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 90381402
3-cyclopentyloxy-N'-hydroxy-2-methylpropanimidamide
CID 43368378
methyl 3-cyclohexyloxybutanoate
CID 43612104
(1-cyclohexyloxy-2-methylpropoxy)cyclohexane
CID 20788615

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane?
The IUPAC name of 1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane (CID 139806384) is 1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane.
What is the SMILES notation for 1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane?
The canonical SMILES for 1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane is CC(COC1CCCCC1)OCC(C)OC1CCCCC1.
What is the InChIKey of 1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane?
The InChIKey is XWFYBGDLYBPFIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O3/c1-15(13-20-17-9-5-3-6-10-17)19-14-16(2)21-18-11-7-4-8-12-18/h15-18H,3-14H2,1-2H3.
What are the key properties of 1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane?
1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane has a molecular weight of 298.47 g/mol, XLogP of 4.48, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane is sourced from PubChem (CID 139806384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).