15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one

C15H20O2 — CID 13047637

IUPAC15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one
SMILESO=c1c2cccc(c1O)CCCCCCCC2
InChIInChI=1S/C15H20O2/c16-14-12-8-5-3-1-2-4-6-9-13(15(14)17)11-7-10-12/h7,10-11H,1-6,8-9H2,(H,16,17)
InChIKeyBQQGHBJODQRYOB-UHFFFAOYSA-N
MW232.32 g/mol
LogP3.19
Rot. Bonds

About 15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one

15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one (PubChem CID 13047637) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one.

Molecular Properties

Compound Name15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one
PubChem CID13047637
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one
SMILESO=c1c2cccc(c1O)CCCCCCCC2
InChIInChI=1S/C15H20O2/c16-14-12-8-5-3-1-2-4-6-9-13(15(14)17)11-7-10-12/h7,10-11H,1-6,8-9H2,(H,16,17)
InChIKeyBQQGHBJODQRYOB-UHFFFAOYSA-N
XLogP3.19
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one?
The IUPAC name of 15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one (CID 13047637) is 15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one.
What is the SMILES notation for 15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one?
The canonical SMILES for 15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one is O=c1c2cccc(c1O)CCCCCCCC2.
What is the InChIKey of 15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one?
The InChIKey is BQQGHBJODQRYOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c16-14-12-8-5-3-1-2-4-6-9-13(15(14)17)11-7-10-12/h7,10-11H,1-6,8-9H2,(H,16,17).
What are the key properties of 15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one?
15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one has a molecular weight of 232.32 g/mol, XLogP of 3.19, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 15-hydroxybicyclo[8.3.2]pentadeca-1(13),10(15),11-trien-14-one is sourced from PubChem (CID 13047637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).