potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide

C8H6KN3O — CID 171818248

IUPACpotassium (5-cyano-6-methylpyridine-2-carbonyl)azanide
SMILESCc1nc(C([NH-])=O)ccc1C#N.[K+]
InChIInChI=1S/C8H7N3O.K/c1-5-6(4-9)2-3-7(11-5)8(10)12;/h2-3H,1H3,(H2,10,12);/q;+1/p-1
InChIKeyAOAUNOGBEQIREI-UHFFFAOYSA-M
MW199.25 g/mol
LogP-1.54
Rot. Bonds1

About potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide

potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide (PubChem CID 171818248) has the molecular formula C8H6KN3O and a molecular weight of 199.25 g/mol. Its IUPAC name is potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide.

Molecular Properties

Compound Namepotassium (5-cyano-6-methylpyridine-2-carbonyl)azanide
PubChem CID171818248
Molecular FormulaC8H6KN3O
Molecular Weight199.25 g/mol
Exact Mass199.01
IUPAC Namepotassium (5-cyano-6-methylpyridine-2-carbonyl)azanide
SMILESCc1nc(C([NH-])=O)ccc1C#N.[K+]
InChIInChI=1S/C8H7N3O.K/c1-5-6(4-9)2-3-7(11-5)8(10)12;/h2-3H,1H3,(H2,10,12);/q;+1/p-1
InChIKeyAOAUNOGBEQIREI-UHFFFAOYSA-M
XLogP-1.54
TPSA77.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-1.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyano-6-methylpyridine-2-carboxylic acid;ethane
CID 143901939
propyl 5-cyano-6-methylpyridine-2-carboxylate
CID 112727103
5-cyano-N-[(2R)-1-hydroxypropan-2-yl]-6-methylpyridine-2-carboxamide
CID 79031139
3-[(5-cyano-6-methylpyridine-2-carbonyl)amino]-2-hydroxypropanoic acid
CID 66166861
2-[[2-[(5-cyano-6-methylpyridine-2-carbonyl)amino]acetyl]amino]acetic acid
CID 43465318
ethyl 2-[(5-cyano-6-methylpyridine-2-carbonyl)-propylamino]acetate
CID 61007860
5-cyano-6-methyl-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
CID 39088130
5-cyano-N-(1-hydroxy-4-methylpentan-2-yl)-6-methylpyridine-2-carboxamide
CID 61247495
5-cyano-N-(1-hydroxypentan-3-yl)-6-methylpyridine-2-carboxamide
CID 115767165
2-[butan-2-yl-(5-cyano-6-methylpyridine-2-carbonyl)amino]acetic acid
CID 60829216
methyl 2-[(5-cyano-6-methylpyridine-2-carbonyl)amino]-3-methylbutanoate
CID 43424083
5-cyano-6-methyl-N-(2-phenoxyphenyl)pyridine-2-carboxamide
CID 39090146

Frequently Asked Questions

What is the IUPAC name of potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide?
The IUPAC name of potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide (CID 171818248) is potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide.
What is the SMILES notation for potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide?
The canonical SMILES for potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide is Cc1nc(C([NH-])=O)ccc1C#N.[K+].
What is the InChIKey of potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide?
The InChIKey is AOAUNOGBEQIREI-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H7N3O.K/c1-5-6(4-9)2-3-7(11-5)8(10)12;/h2-3H,1H3,(H2,10,12);/q;+1/p-1.
What are the key properties of potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide?
potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide has a molecular weight of 199.25 g/mol, XLogP of -1.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium (5-cyano-6-methylpyridine-2-carbonyl)azanide is sourced from PubChem (CID 171818248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).