potassium 2-pyridin-3-ylquinoline-4-carboxylate

C15H9KN2O2 — CID 23684916

IUPACpotassium 2-pyridin-3-ylquinoline-4-carboxylate
SMILESO=C([O-])c1cc(-c2cccnc2)nc2ccccc12.[K+]
InChIInChI=1S/C15H10N2O2.K/c18-15(19)12-8-14(10-4-3-7-16-9-10)17-13-6-2-1-5-11(12)13;/h1-9H,(H,18,19);/q;+1/p-1
InChIKeyVUBDSUVRPSVQAP-UHFFFAOYSA-M
MW288.35 g/mol
LogP-1.34
Rot. Bonds2

About potassium 2-pyridin-3-ylquinoline-4-carboxylate

potassium 2-pyridin-3-ylquinoline-4-carboxylate (PubChem CID 23684916) has the molecular formula C15H9KN2O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is potassium 2-pyridin-3-ylquinoline-4-carboxylate.

Molecular Properties

Compound Namepotassium 2-pyridin-3-ylquinoline-4-carboxylate
PubChem CID23684916
Molecular FormulaC15H9KN2O2
Molecular Weight288.35 g/mol
Exact Mass288.03
IUPAC Namepotassium 2-pyridin-3-ylquinoline-4-carboxylate
SMILESO=C([O-])c1cc(-c2cccnc2)nc2ccccc12.[K+]
InChIInChI=1S/C15H10N2O2.K/c18-15(19)12-8-14(10-4-3-7-16-9-10)17-13-6-2-1-5-11(12)13;/h1-9H,(H,18,19);/q;+1/p-1
InChIKeyVUBDSUVRPSVQAP-UHFFFAOYSA-M
XLogP-1.34
TPSA65.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 5-1.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze potassium 2-pyridin-3-ylquinoline-4-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of potassium 2-pyridin-3-ylquinoline-4-carboxylate?
The IUPAC name of potassium 2-pyridin-3-ylquinoline-4-carboxylate (CID 23684916) is potassium 2-pyridin-3-ylquinoline-4-carboxylate.
What is the SMILES notation for potassium 2-pyridin-3-ylquinoline-4-carboxylate?
The canonical SMILES for potassium 2-pyridin-3-ylquinoline-4-carboxylate is O=C([O-])c1cc(-c2cccnc2)nc2ccccc12.[K+].
What is the InChIKey of potassium 2-pyridin-3-ylquinoline-4-carboxylate?
The InChIKey is VUBDSUVRPSVQAP-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H10N2O2.K/c18-15(19)12-8-14(10-4-3-7-16-9-10)17-13-6-2-1-5-11(12)13;/h1-9H,(H,18,19);/q;+1/p-1.
What are the key properties of potassium 2-pyridin-3-ylquinoline-4-carboxylate?
potassium 2-pyridin-3-ylquinoline-4-carboxylate has a molecular weight of 288.35 g/mol, XLogP of -1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-pyridin-3-ylquinoline-4-carboxylate is sourced from PubChem (CID 23684916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).