[(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol

C11H16O2 — CID 118281653

IUPAC[(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol
SMILESCOC12C=CC=C(CC[C@@H]1CO)C2
InChIInChI=1S/C11H16O2/c1-13-11-6-2-3-9(7-11)4-5-10(11)8-12/h2-3,6,10,12H,4-5,7-8H2,1H3/t10-,11?/m1/s1
InChIKeyFDINFUNVIPJNOL-NFJWQWPMSA-N
MW180.25 g/mol
LogP1.66
Rot. Bonds2

About [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol

[(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol (PubChem CID 118281653) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol.

Molecular Properties

Compound Name[(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol
PubChem CID118281653
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name[(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol
SMILESCOC12C=CC=C(CC[C@@H]1CO)C2
InChIInChI=1S/C11H16O2/c1-13-11-6-2-3-9(7-11)4-5-10(11)8-12/h2-3,6,10,12H,4-5,7-8H2,1H3/t10-,11?/m1/s1
InChIKeyFDINFUNVIPJNOL-NFJWQWPMSA-N
XLogP1.66
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol 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 [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol?
The IUPAC name of [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol (CID 118281653) is [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol.
What is the SMILES notation for [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol?
The canonical SMILES for [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol is COC12C=CC=C(CC[C@@H]1CO)C2.
What is the InChIKey of [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol?
The InChIKey is FDINFUNVIPJNOL-NFJWQWPMSA-N. The full InChI is InChI=1S/C11H16O2/c1-13-11-6-2-3-9(7-11)4-5-10(11)8-12/h2-3,6,10,12H,4-5,7-8H2,1H3/t10-,11?/m1/s1.
What are the key properties of [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol?
[(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol has a molecular weight of 180.25 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-methoxy-2-bicyclo[3.3.1]nona-5,7-dienyl]methanol is sourced from PubChem (CID 118281653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).