potassium pyridin-2-olate

C5H4KNO — CID 23665692

IUPACpotassium pyridin-2-olate
SMILES[K+].[O-]c1ccccn1
InChIInChI=1S/C5H5NO.K/c7-5-3-1-2-4-6-5;/h1-4H,(H,6,7);/q;+1/p-1
InChIKeyAZSRPGCDMLRWEW-UHFFFAOYSA-M
MW133.19 g/mol
LogP-2.84
Rot. Bonds

About potassium pyridin-2-olate

potassium pyridin-2-olate (PubChem CID 23665692) has the molecular formula C5H4KNO and a molecular weight of 133.19 g/mol. Its IUPAC name is potassium pyridin-2-olate.

Molecular Properties

Compound Namepotassium pyridin-2-olate
PubChem CID23665692
Molecular FormulaC5H4KNO
Molecular Weight133.19 g/mol
Exact Mass132.99
IUPAC Namepotassium pyridin-2-olate
SMILES[K+].[O-]c1ccccn1
InChIInChI=1S/C5H5NO.K/c7-5-3-1-2-4-6-5;/h1-4H,(H,6,7);/q;+1/p-1
InChIKeyAZSRPGCDMLRWEW-UHFFFAOYSA-M
XLogP-2.84
TPSA35.95 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.19
LogP ≤ 5-2.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of potassium pyridin-2-olate?
The IUPAC name of potassium pyridin-2-olate (CID 23665692) is potassium pyridin-2-olate.
What is the SMILES notation for potassium pyridin-2-olate?
The canonical SMILES for potassium pyridin-2-olate is [K+].[O-]c1ccccn1.
What is the InChIKey of potassium pyridin-2-olate?
The InChIKey is AZSRPGCDMLRWEW-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H5NO.K/c7-5-3-1-2-4-6-5;/h1-4H,(H,6,7);/q;+1/p-1.
What are the key properties of potassium pyridin-2-olate?
potassium pyridin-2-olate has a molecular weight of 133.19 g/mol, XLogP of -2.84, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium pyridin-2-olate is sourced from PubChem (CID 23665692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).