(3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol

C11H20O — CID 115013484

IUPAC(3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol
SMILESCC1(C)CC2CCC(C1)C2CO
InChIInChI=1S/C11H20O/c1-11(2)5-8-3-4-9(6-11)10(8)7-12/h8-10,12H,3-7H2,1-2H3
InChIKeyJZYADOHNPXQJQC-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.44
Rot. Bonds1

About (3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol

(3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol (PubChem CID 115013484) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is (3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol.

Molecular Properties

Compound Name(3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol
PubChem CID115013484
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name(3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol
SMILESCC1(C)CC2CCC(C1)C2CO
InChIInChI=1S/C11H20O/c1-11(2)5-8-3-4-9(6-11)10(8)7-12/h8-10,12H,3-7H2,1-2H3
InChIKeyJZYADOHNPXQJQC-UHFFFAOYSA-N
XLogP2.44
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol?
The IUPAC name of (3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol (CID 115013484) is (3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol.
What is the SMILES notation for (3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol?
The canonical SMILES for (3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol is CC1(C)CC2CCC(C1)C2CO.
What is the InChIKey of (3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol?
The InChIKey is JZYADOHNPXQJQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-11(2)5-8-3-4-9(6-11)10(8)7-12/h8-10,12H,3-7H2,1-2H3.
What are the key properties of (3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol?
(3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol has a molecular weight of 168.28 g/mol, XLogP of 2.44, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-dimethyl-8-bicyclo[3.2.1]octanyl)methanol is sourced from PubChem (CID 115013484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).