(1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol

C10H14O — CID 45082915

IUPAC(1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol
SMILESO[C@@H]1C[C@@H]2C[C@H]1[C@H]1C=CC[C@@H]21
InChIInChI=1S/C10H14O/c11-10-5-6-4-9(10)8-3-1-2-7(6)8/h1,3,6-11H,2,4-5H2/t6-,7-,8-,9-,10+/m0/s1
InChIKeyLDUKQFUHJZHLRC-BQHMLIOBSA-N
MW150.22 g/mol
LogP1.58
Rot. Bonds

About (1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol

(1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol (PubChem CID 45082915) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is (1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol.

Molecular Properties

Compound Name(1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol
PubChem CID45082915
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name(1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol
SMILESO[C@@H]1C[C@@H]2C[C@H]1[C@H]1C=CC[C@@H]21
InChIInChI=1S/C10H14O/c11-10-5-6-4-9(10)8-3-1-2-7(6)8/h1,3,6-11H,2,4-5H2/t6-,7-,8-,9-,10+/m0/s1
InChIKeyLDUKQFUHJZHLRC-BQHMLIOBSA-N
XLogP1.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.58
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 (1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol?
The IUPAC name of (1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol (CID 45082915) is (1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol.
What is the SMILES notation for (1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol?
The canonical SMILES for (1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol is O[C@@H]1C[C@@H]2C[C@H]1[C@H]1C=CC[C@@H]21.
What is the InChIKey of (1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol?
The InChIKey is LDUKQFUHJZHLRC-BQHMLIOBSA-N. The full InChI is InChI=1S/C10H14O/c11-10-5-6-4-9(10)8-3-1-2-7(6)8/h1,3,6-11H,2,4-5H2/t6-,7-,8-,9-,10+/m0/s1.
What are the key properties of (1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol?
(1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol has a molecular weight of 150.22 g/mol, XLogP of 1.58, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2S,6S,7S,8R)-tricyclo[5.2.1.02,6]dec-4-en-8-ol is sourced from PubChem (CID 45082915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).