1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol

C14H24O2 — CID 20746701

IUPAC1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol
SMILESCC1C2CC(C3(O)CCCCC3)C(O2)C1C
InChIInChI=1S/C14H24O2/c1-9-10(2)13-11(8-12(9)16-13)14(15)6-4-3-5-7-14/h9-13,15H,3-8H2,1-2H3
InChIKeyGWGKVGQGUJMEAA-UHFFFAOYSA-N
MW224.34 g/mol
LogP2.74
Rot. Bonds1

About 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol

1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol (PubChem CID 20746701) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol
PubChem CID20746701
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol
SMILESCC1C2CC(C3(O)CCCCC3)C(O2)C1C
InChIInChI=1S/C14H24O2/c1-9-10(2)13-11(8-12(9)16-13)14(15)6-4-3-5-7-14/h9-13,15H,3-8H2,1-2H3
InChIKeyGWGKVGQGUJMEAA-UHFFFAOYSA-N
XLogP2.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol?
The IUPAC name of 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol (CID 20746701) is 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol.
What is the SMILES notation for 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol?
The canonical SMILES for 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol is CC1C2CC(C3(O)CCCCC3)C(O2)C1C.
What is the InChIKey of 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol?
The InChIKey is GWGKVGQGUJMEAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-9-10(2)13-11(8-12(9)16-13)14(15)6-4-3-5-7-14/h9-13,15H,3-8H2,1-2H3.
What are the key properties of 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol?
1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol has a molecular weight of 224.34 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 20746701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).