(2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol

C12H20O2 — CID 89351665

IUPAC(2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol
SMILESCC1C2CC(C1C)C1(CCO[C@H]1O)C2
InChIInChI=1S/C12H20O2/c1-7-8(2)10-5-9(7)6-12(10)3-4-14-11(12)13/h7-11,13H,3-6H2,1-2H3/t7?,8?,9?,10?,11-,12?/m1/s1
InChIKeyWCRPNIAYVAYDQB-AZOGYHBKSA-N
MW196.29 g/mol
LogP2.02
Rot. Bonds

About (2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol

(2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol (PubChem CID 89351665) has the molecular formula C12H20O2 and a molecular weight of 196.29 g/mol. Its IUPAC name is (2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol.

Molecular Properties

Compound Name(2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol
PubChem CID89351665
Molecular FormulaC12H20O2
Molecular Weight196.29 g/mol
Exact Mass196.15
IUPAC Name(2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol
SMILESCC1C2CC(C1C)C1(CCO[C@H]1O)C2
InChIInChI=1S/C12H20O2/c1-7-8(2)10-5-9(7)6-12(10)3-4-14-11(12)13/h7-11,13H,3-6H2,1-2H3/t7?,8?,9?,10?,11-,12?/m1/s1
InChIKeyWCRPNIAYVAYDQB-AZOGYHBKSA-N
XLogP2.02
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol?
The IUPAC name of (2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol (CID 89351665) is (2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol.
What is the SMILES notation for (2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol?
The canonical SMILES for (2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol is CC1C2CC(C1C)C1(CCO[C@H]1O)C2.
What is the InChIKey of (2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol?
The InChIKey is WCRPNIAYVAYDQB-AZOGYHBKSA-N. The full InChI is InChI=1S/C12H20O2/c1-7-8(2)10-5-9(7)6-12(10)3-4-14-11(12)13/h7-11,13H,3-6H2,1-2H3/t7?,8?,9?,10?,11-,12?/m1/s1.
What are the key properties of (2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol?
(2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol has a molecular weight of 196.29 g/mol, XLogP of 2.02, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2'R)-5,6-dimethylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-ol is sourced from PubChem (CID 89351665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).