(1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol

C11H16O2 — CID 100930541

IUPAC(1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol
SMILESCC12C=CC(O1)C1CCCC12CO
InChIInChI=1S/C11H16O2/c1-10-6-4-9(13-10)8-3-2-5-11(8,10)7-12/h4,6,8-9,12H,2-3,5,7H2,1H3
InChIKeyNCZPSUIYJVJKNN-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.49
Rot. Bonds1

About (1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol

(1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol (PubChem CID 100930541) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is (1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol.

Molecular Properties

Compound Name(1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol
PubChem CID100930541
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name(1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol
SMILESCC12C=CC(O1)C1CCCC12CO
InChIInChI=1S/C11H16O2/c1-10-6-4-9(13-10)8-3-2-5-11(8,10)7-12/h4,6,8-9,12H,2-3,5,7H2,1H3
InChIKeyNCZPSUIYJVJKNN-UHFFFAOYSA-N
XLogP1.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

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CID 144518883
(1-methyl-6-bicyclo[3.1.0]hexanyl)methanol
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CID 10803435
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CID 143298757
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(1,2-dimethylcyclopentyl)methanol
CID 544196
(1R,2S,6S)-6-methylbicyclo[4.1.0]heptan-2-ol
CID 10931443
[(1S,2R)-1,2-dimethylcyclopentyl]methanol
CID 167089966
2,6,6,10-tetramethyl-1-oxaspiro[4.5]dec-3-ene
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Frequently Asked Questions

What is the IUPAC name of (1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol?
The IUPAC name of (1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol (CID 100930541) is (1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol.
What is the SMILES notation for (1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol?
The canonical SMILES for (1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol is CC12C=CC(O1)C1CCCC12CO.
What is the InChIKey of (1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol?
The InChIKey is NCZPSUIYJVJKNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O2/c1-10-6-4-9(13-10)8-3-2-5-11(8,10)7-12/h4,6,8-9,12H,2-3,5,7H2,1H3.
What are the key properties of (1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol?
(1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol has a molecular weight of 180.25 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-10-oxatricyclo[5.2.1.02,6]dec-8-en-2-yl)methanol is sourced from PubChem (CID 100930541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).