furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol

C13H18O3 — CID 79899469

IUPACfuran-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol
SMILESOC(c1ccco1)C1CCOC2(CCC2)C1
InChIInChI=1S/C13H18O3/c14-12(11-3-1-7-15-11)10-4-8-16-13(9-10)5-2-6-13/h1,3,7,10,12,14H,2,4-6,8-9H2
InChIKeyYBDOLXFTNYXWDR-UHFFFAOYSA-N
MW222.28 g/mol
LogP2.66
Rot. Bonds2

About furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol

furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol (PubChem CID 79899469) has the molecular formula C13H18O3 and a molecular weight of 222.28 g/mol. Its IUPAC name is furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol.

Molecular Properties

Compound Namefuran-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol
PubChem CID79899469
Molecular FormulaC13H18O3
Molecular Weight222.28 g/mol
Exact Mass222.13
IUPAC Namefuran-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol
SMILESOC(c1ccco1)C1CCOC2(CCC2)C1
InChIInChI=1S/C13H18O3/c14-12(11-3-1-7-15-11)10-4-8-16-13(9-10)5-2-6-13/h1,3,7,10,12,14H,2,4-6,8-9H2
InChIKeyYBDOLXFTNYXWDR-UHFFFAOYSA-N
XLogP2.66
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.28
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-methylfuran-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methanol
CID 113453307
[3-(difluoromethyl)phenyl]-(5-oxaspiro[3.5]nonan-8-yl)methanol
CID 115527624
(3-iodophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methanol
CID 115819602
(3-methylfuran-2-yl)-(1-oxaspiro[5.5]undecan-4-yl)methanol
CID 104800788
(3-bromofuran-2-yl)-(1-oxaspiro[5.5]undecan-4-yl)methanol
CID 106886310
N-[furan-2-yl(1-oxaspiro[5.5]undecan-4-yl)methyl]ethanamine
CID 79914001
(S)-cyclopropyl(furan-2-yl)methanol
CID 39235067
(3-aminophenyl)-(6-oxaspiro[4.5]decan-9-yl)methanol
CID 106695822
(3,4-dichlorophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methanol
CID 79900057
(2-iodophenyl)-(1-oxaspiro[5.5]undecan-4-yl)methanol
CID 115823060
(2,4-dibromophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methanol
CID 107947647
(2,3-dimethylphenyl)-(6-oxaspiro[4.5]decan-9-yl)methanol
CID 79913941

Frequently Asked Questions

What is the IUPAC name of furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol?
The IUPAC name of furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol (CID 79899469) is furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol.
What is the SMILES notation for furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol?
The canonical SMILES for furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol is OC(c1ccco1)C1CCOC2(CCC2)C1.
What is the InChIKey of furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol?
The InChIKey is YBDOLXFTNYXWDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O3/c14-12(11-3-1-7-15-11)10-4-8-16-13(9-10)5-2-6-13/h1,3,7,10,12,14H,2,4-6,8-9H2.
What are the key properties of furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol?
furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol has a molecular weight of 222.28 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanol is sourced from PubChem (CID 79899469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).