potassium 2-phenylquinolin-1-ium-8-olate

C15H11KNO+ — CID 58233309

IUPACpotassium 2-phenylquinolin-1-ium-8-olate
SMILES[K+].[O-]c1cccc2ccc(-c3ccccc3)[nH+]c12
InChIInChI=1S/C15H11NO.K/c17-14-8-4-7-12-9-10-13(16-15(12)14)11-5-2-1-3-6-11;/h1-10,17H;/q;+1
InChIKeyULNRDDJZUNBNCI-UHFFFAOYSA-N
MW260.36 g/mol
LogP-0.60
Rot. Bonds1

About potassium 2-phenylquinolin-1-ium-8-olate

potassium 2-phenylquinolin-1-ium-8-olate (PubChem CID 58233309) has the molecular formula C15H11KNO+ and a molecular weight of 260.36 g/mol. Its IUPAC name is potassium 2-phenylquinolin-1-ium-8-olate.

Molecular Properties

Compound Namepotassium 2-phenylquinolin-1-ium-8-olate
PubChem CID58233309
Molecular FormulaC15H11KNO+
Molecular Weight260.36 g/mol
Exact Mass260.05
IUPAC Namepotassium 2-phenylquinolin-1-ium-8-olate
SMILES[K+].[O-]c1cccc2ccc(-c3ccccc3)[nH+]c12
InChIInChI=1S/C15H11NO.K/c17-14-8-4-7-12-9-10-13(16-15(12)14)11-5-2-1-3-6-11;/h1-10,17H;/q;+1
InChIKeyULNRDDJZUNBNCI-UHFFFAOYSA-N
XLogP-0.60
TPSA37.20 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 5-0.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of potassium 2-phenylquinolin-1-ium-8-olate?
The IUPAC name of potassium 2-phenylquinolin-1-ium-8-olate (CID 58233309) is potassium 2-phenylquinolin-1-ium-8-olate.
What is the SMILES notation for potassium 2-phenylquinolin-1-ium-8-olate?
The canonical SMILES for potassium 2-phenylquinolin-1-ium-8-olate is [K+].[O-]c1cccc2ccc(-c3ccccc3)[nH+]c12.
What is the InChIKey of potassium 2-phenylquinolin-1-ium-8-olate?
The InChIKey is ULNRDDJZUNBNCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO.K/c17-14-8-4-7-12-9-10-13(16-15(12)14)11-5-2-1-3-6-11;/h1-10,17H;/q;+1.
What are the key properties of potassium 2-phenylquinolin-1-ium-8-olate?
potassium 2-phenylquinolin-1-ium-8-olate has a molecular weight of 260.36 g/mol, XLogP of -0.60, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-phenylquinolin-1-ium-8-olate is sourced from PubChem (CID 58233309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).