1-hydroxytricyclo[4.3.1.03,8]decan-4-one

C10H14O2 — CID 14418310

IUPAC1-hydroxytricyclo[4.3.1.03,8]decan-4-one
SMILESO=C1CC2CC3CC(O)(C2)CC13
InChIInChI=1S/C10H14O2/c11-9-2-6-1-7-4-10(12,3-6)5-8(7)9/h6-8,12H,1-5H2
InChIKeyRGEUEDGLFOEPEA-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.13
Rot. Bonds

About 1-hydroxytricyclo[4.3.1.03,8]decan-4-one

1-hydroxytricyclo[4.3.1.03,8]decan-4-one (PubChem CID 14418310) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is 1-hydroxytricyclo[4.3.1.03,8]decan-4-one.

Molecular Properties

Compound Name1-hydroxytricyclo[4.3.1.03,8]decan-4-one
PubChem CID14418310
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name1-hydroxytricyclo[4.3.1.03,8]decan-4-one
SMILESO=C1CC2CC3CC(O)(C2)CC13
InChIInChI=1S/C10H14O2/c11-9-2-6-1-7-4-10(12,3-6)5-8(7)9/h6-8,12H,1-5H2
InChIKeyRGEUEDGLFOEPEA-UHFFFAOYSA-N
XLogP1.13
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxytricyclo[4.3.1.03,8]decan-4-one?
The IUPAC name of 1-hydroxytricyclo[4.3.1.03,8]decan-4-one (CID 14418310) is 1-hydroxytricyclo[4.3.1.03,8]decan-4-one.
What is the SMILES notation for 1-hydroxytricyclo[4.3.1.03,8]decan-4-one?
The canonical SMILES for 1-hydroxytricyclo[4.3.1.03,8]decan-4-one is O=C1CC2CC3CC(O)(C2)CC13.
What is the InChIKey of 1-hydroxytricyclo[4.3.1.03,8]decan-4-one?
The InChIKey is RGEUEDGLFOEPEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2/c11-9-2-6-1-7-4-10(12,3-6)5-8(7)9/h6-8,12H,1-5H2.
What are the key properties of 1-hydroxytricyclo[4.3.1.03,8]decan-4-one?
1-hydroxytricyclo[4.3.1.03,8]decan-4-one has a molecular weight of 166.22 g/mol, XLogP of 1.13, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxytricyclo[4.3.1.03,8]decan-4-one is sourced from PubChem (CID 14418310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).