3-hydroxy-2-phenyl-2,3-dihydroinden-1-one

C15H12O2 — CID 74966460

IUPAC3-hydroxy-2-phenyl-2,3-dihydroinden-1-one
SMILESO=C1c2ccccc2C(O)C1c1ccccc1
InChIInChI=1S/C15H12O2/c16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10/h1-9,13-14,16H
InChIKeyBOFWHEVYJRKXQB-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.70
Rot. Bonds1

About 3-hydroxy-2-phenyl-2,3-dihydroinden-1-one

3-hydroxy-2-phenyl-2,3-dihydroinden-1-one (PubChem CID 74966460) has the molecular formula C15H12O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 3-hydroxy-2-phenyl-2,3-dihydroinden-1-one.

Molecular Properties

Compound Name3-hydroxy-2-phenyl-2,3-dihydroinden-1-one
PubChem CID74966460
Molecular FormulaC15H12O2
Molecular Weight224.26 g/mol
Exact Mass224.08
IUPAC Name3-hydroxy-2-phenyl-2,3-dihydroinden-1-one
SMILESO=C1c2ccccc2C(O)C1c1ccccc1
InChIInChI=1S/C15H12O2/c16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10/h1-9,13-14,16H
InChIKeyBOFWHEVYJRKXQB-UHFFFAOYSA-N
XLogP2.70
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-phenyl-2,3-dihydroinden-1-one?
The IUPAC name of 3-hydroxy-2-phenyl-2,3-dihydroinden-1-one (CID 74966460) is 3-hydroxy-2-phenyl-2,3-dihydroinden-1-one.
What is the SMILES notation for 3-hydroxy-2-phenyl-2,3-dihydroinden-1-one?
The canonical SMILES for 3-hydroxy-2-phenyl-2,3-dihydroinden-1-one is O=C1c2ccccc2C(O)C1c1ccccc1.
What is the InChIKey of 3-hydroxy-2-phenyl-2,3-dihydroinden-1-one?
The InChIKey is BOFWHEVYJRKXQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12O2/c16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10/h1-9,13-14,16H.
What are the key properties of 3-hydroxy-2-phenyl-2,3-dihydroinden-1-one?
3-hydroxy-2-phenyl-2,3-dihydroinden-1-one has a molecular weight of 224.26 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-phenyl-2,3-dihydroinden-1-one is sourced from PubChem (CID 74966460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).