3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol

C14H24O3 — CID 79913860

IUPAC3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol
SMILESOC1(C2CCOC3(CCCC3)C2)CCCOC1
InChIInChI=1S/C14H24O3/c15-14(7-3-8-16-11-14)12-4-9-17-13(10-12)5-1-2-6-13/h12,15H,1-11H2
InChIKeyKBIOEUORTCGVRU-UHFFFAOYSA-N
MW240.34 g/mol
LogP2.27
Rot. Bonds1

About 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol

3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol (PubChem CID 79913860) has the molecular formula C14H24O3 and a molecular weight of 240.34 g/mol. Its IUPAC name is 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol.

Molecular Properties

Compound Name3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol
PubChem CID79913860
Molecular FormulaC14H24O3
Molecular Weight240.34 g/mol
Exact Mass240.17
IUPAC Name3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol
SMILESOC1(C2CCOC3(CCCC3)C2)CCCOC1
InChIInChI=1S/C14H24O3/c15-14(7-3-8-16-11-14)12-4-9-17-13(10-12)5-1-2-6-13/h12,15H,1-11H2
InChIKeyKBIOEUORTCGVRU-UHFFFAOYSA-N
XLogP2.27
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol with MolForge

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Related Compounds

1-(1-oxaspiro[5.5]undecan-4-yl)cyclohexan-1-ol
CID 79900915
1-(6-oxaspiro[4.5]decan-9-yl)cyclobutan-1-ol
CID 79912854
1-(2,6-dioxaspiro[4.5]decan-9-yl)cyclobutan-1-ol
CID 79912746
2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)cyclohexan-1-ol
CID 79898835
4,4-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)cycloheptan-1-ol
CID 79913776
3-(2,6-dioxaspiro[4.5]decan-9-yl)piperidin-3-ol
CID 79902057
2,2-dimethyl-4-(6-oxaspiro[4.5]decan-9-yl)oxan-4-ol
CID 79912832
3-(5-oxaspiro[3.5]nonan-8-yl)oxane-3-carboxylic acid
CID 103739463
4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol
CID 103982956
3-amino-1-(2,6-dioxaspiro[4.5]decan-9-yl)cyclohexan-1-ol
CID 80561361
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-4,4-dimethylcyclohexan-1-ol
CID 79912494
4-(6-oxaspiro[4.5]decan-9-yl)-1-propan-2-ylazepan-4-ol
CID 79907158

Frequently Asked Questions

What is the IUPAC name of 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol?
The IUPAC name of 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol (CID 79913860) is 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol.
What is the SMILES notation for 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol?
The canonical SMILES for 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol is OC1(C2CCOC3(CCCC3)C2)CCCOC1.
What is the InChIKey of 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol?
The InChIKey is KBIOEUORTCGVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O3/c15-14(7-3-8-16-11-14)12-4-9-17-13(10-12)5-1-2-6-13/h12,15H,1-11H2.
What are the key properties of 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol?
3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol has a molecular weight of 240.34 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol is sourced from PubChem (CID 79913860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).