5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol

C11H18O — CID 143087395

IUPAC5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol
SMILESC/C=C\C1C(C)C2CC(O)C1C2
InChIInChI=1S/C11H18O/c1-3-4-9-7(2)8-5-10(9)11(12)6-8/h3-4,7-12H,5-6H2,1-2H3/b4-3-
InChIKeyHKFBGGRSSMFEHK-ARJAWSKDSA-N
MW166.26 g/mol
LogP2.22
Rot. Bonds1

About 5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol

5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol (PubChem CID 143087395) has the molecular formula C11H18O and a molecular weight of 166.26 g/mol. Its IUPAC name is 5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol.

Molecular Properties

Compound Name5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol
PubChem CID143087395
Molecular FormulaC11H18O
Molecular Weight166.26 g/mol
Exact Mass166.14
IUPAC Name5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol
SMILESC/C=C\C1C(C)C2CC(O)C1C2
InChIInChI=1S/C11H18O/c1-3-4-9-7(2)8-5-10(9)11(12)6-8/h3-4,7-12H,5-6H2,1-2H3/b4-3-
InChIKeyHKFBGGRSSMFEHK-ARJAWSKDSA-N
XLogP2.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.26
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol?
The IUPAC name of 5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol (CID 143087395) is 5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol.
What is the SMILES notation for 5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol?
The canonical SMILES for 5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol is C/C=C\C1C(C)C2CC(O)C1C2.
What is the InChIKey of 5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol?
The InChIKey is HKFBGGRSSMFEHK-ARJAWSKDSA-N. The full InChI is InChI=1S/C11H18O/c1-3-4-9-7(2)8-5-10(9)11(12)6-8/h3-4,7-12H,5-6H2,1-2H3/b4-3-.
What are the key properties of 5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol?
5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol has a molecular weight of 166.26 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-[(Z)-prop-1-enyl]bicyclo[2.2.1]heptan-2-ol is sourced from PubChem (CID 143087395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).