(1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one

C11H14O2 — CID 10877700

IUPAC(1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one
SMILESO=C1C=C2CCC[C@]23CC[C@@]1(O)C3
InChIInChI=1S/C11H14O2/c12-9-6-8-2-1-3-10(8)4-5-11(9,13)7-10/h6,13H,1-5,7H2/t10-,11-/m1/s1
InChIKeyMUDGMZAGUDSDLD-GHMZBOCLSA-N
MW178.23 g/mol
LogP1.58
Rot. Bonds

About (1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one

(1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one (PubChem CID 10877700) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is (1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one.

Molecular Properties

Compound Name(1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one
PubChem CID10877700
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name(1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one
SMILESO=C1C=C2CCC[C@]23CC[C@@]1(O)C3
InChIInChI=1S/C11H14O2/c12-9-6-8-2-1-3-10(8)4-5-11(9,13)7-10/h6,13H,1-5,7H2/t10-,11-/m1/s1
InChIKeyMUDGMZAGUDSDLD-GHMZBOCLSA-N
XLogP1.58
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one?
The IUPAC name of (1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one (CID 10877700) is (1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one.
What is the SMILES notation for (1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one?
The canonical SMILES for (1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one is O=C1C=C2CCC[C@]23CC[C@@]1(O)C3.
What is the InChIKey of (1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one?
The InChIKey is MUDGMZAGUDSDLD-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H14O2/c12-9-6-8-2-1-3-10(8)4-5-11(9,13)7-10/h6,13H,1-5,7H2/t10-,11-/m1/s1.
What are the key properties of (1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one?
(1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one has a molecular weight of 178.23 g/mol, XLogP of 1.58, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,8R)-8-hydroxytricyclo[6.2.1.01,5]undec-5-en-7-one is sourced from PubChem (CID 10877700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).