3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol

C10H16O2 — CID 15594969

IUPAC3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol
SMILESCC1(O)OCC2C3CCC(C3)C21
InChIInChI=1S/C10H16O2/c1-10(11)9-7-3-2-6(4-7)8(9)5-12-10/h6-9,11H,2-5H2,1H3
InChIKeyGEMDOWLSPVAUMY-UHFFFAOYSA-N
MW168.24 g/mol
LogP1.39
Rot. Bonds

About 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol

3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol (PubChem CID 15594969) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol.

Molecular Properties

Compound Name3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol
PubChem CID15594969
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol
SMILESCC1(O)OCC2C3CCC(C3)C21
InChIInChI=1S/C10H16O2/c1-10(11)9-7-3-2-6(4-7)8(9)5-12-10/h6-9,11H,2-5H2,1H3
InChIKeyGEMDOWLSPVAUMY-UHFFFAOYSA-N
XLogP1.39
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol with MolForge

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Related Compounds

4-(5,6-Dimethyl-2-bicyclo[2.2.1]heptanyl)-3,3-difluoro-2-(trifluoromethyl)oxolan-2-ol
CID 57676511
5-(5,6-Dimethyl-2-bicyclo[2.2.1]heptanyl)-3,3-difluoro-2-(trifluoromethyl)oxolan-2-ol
CID 57676693
4-(2-Bicyclo[2.2.1]heptanyl)-3,3-difluoro-2-(trifluoromethyl)oxolan-2-ol
CID 57983949
[3-(Diethoxymethyl)-2-bicyclo[2.2.1]heptanyl]methanol
CID 12800688
1,3-Dimethoxyoctahydro-4,7-methano-2-benzofuran
CID 13031344
4,7-Methanoisobenzofuran-1-ol, octahydro-
CID 13504705
(1S,2R,6R,7R)-4-oxatricyclo[5.2.1.02,6]decan-3-ol
CID 13504706
(1R,2S,6R,7S)-3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol
CID 18606840
(1R,2S,6R,7S)-4-oxatricyclo[5.2.1.02,6]decan-3-ol
CID 54537554
(1R,2S)-2-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol
CID 58143073
2-Methyl-4-oxatricyclo[5.2.1.02,6]-decan-3-ol
CID 59602256
(1R)-4-oxatricyclo[5.2.1.02,6]decan-3-ol
CID 59649212

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol?
The IUPAC name of 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol (CID 15594969) is 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol.
What is the SMILES notation for 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol?
The canonical SMILES for 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol is CC1(O)OCC2C3CCC(C3)C21.
What is the InChIKey of 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol?
The InChIKey is GEMDOWLSPVAUMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-10(11)9-7-3-2-6(4-7)8(9)5-12-10/h6-9,11H,2-5H2,1H3.
What are the key properties of 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol?
3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol has a molecular weight of 168.24 g/mol, XLogP of 1.39, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-oxatricyclo[5.2.1.02,6]decan-3-ol is sourced from PubChem (CID 15594969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).