potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide

C10H12KN — CID 162736215

IUPACpotassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide
SMILESC=Cc1nc[c-]cc1C(C)C.[K+]
InChIInChI=1S/C10H12N.K/c1-4-10-9(8(2)3)6-5-7-11-10;/h4,6-8H,1H2,2-3H3;/q-1;+1
InChIKeySEXDARQRKHLPJZ-UHFFFAOYSA-N
MW185.31 g/mol
LogP-0.35
Rot. Bonds2

About potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide

potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide (PubChem CID 162736215) has the molecular formula C10H12KN and a molecular weight of 185.31 g/mol. Its IUPAC name is potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide.

Molecular Properties

Compound Namepotassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide
PubChem CID162736215
Molecular FormulaC10H12KN
Molecular Weight185.31 g/mol
Exact Mass185.06
IUPAC Namepotassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide
SMILESC=Cc1nc[c-]cc1C(C)C.[K+]
InChIInChI=1S/C10H12N.K/c1-4-10-9(8(2)3)6-5-7-11-10;/h4,6-8H,1H2,2-3H3;/q-1;+1
InChIKeySEXDARQRKHLPJZ-UHFFFAOYSA-N
XLogP-0.35
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 5-0.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

1-(4-ethenylpyrimidin-5-yl)ethanethiol
CID 163904160
2,3-bis(ethenyl)-1,4-di(propan-2-yl)benzene
CID 142450771
4,5-bis(ethenyl)-6-propan-2-ylpyrimidine
CID 143453413
(1R)-1-(2-ethenyl-3-pyridinyl)-N-methylethanamine
CID 74890359
2-ethenyl-1,3,5-tri(propan-2-yl)benzene
CID 12920624
2-chloro-1-ethenyl-3-propan-2-ylbenzene
CID 118269122
6-ethenyl-2-methyl-3-propan-2-ylpyridine
CID 164556362
(1S)-1-(2-ethenyl-3-pyridinyl)propan-1-amine
CID 74788873
N-(5-ethenyl-3-propan-2-ylimidazol-4-yl)methanimine
CID 142363960
ethane;2-ethenyl-5-propan-2-yl-3-[(Z)-prop-1-enyl]pyridine
CID 178008358
5-ethenyl-1-methyl-4-propan-2-yltriazole
CID 171723470
4,5-bis(ethenyl)triazine;ethane
CID 145045401

Frequently Asked Questions

What is the IUPAC name of potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide?
The IUPAC name of potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide (CID 162736215) is potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide.
What is the SMILES notation for potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide?
The canonical SMILES for potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide is C=Cc1nc[c-]cc1C(C)C.[K+].
What is the InChIKey of potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide?
The InChIKey is SEXDARQRKHLPJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N.K/c1-4-10-9(8(2)3)6-5-7-11-10;/h4,6-8H,1H2,2-3H3;/q-1;+1.
What are the key properties of potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide?
potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide has a molecular weight of 185.31 g/mol, XLogP of -0.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 6-ethenyl-5-propan-2-yl-3H-pyridin-3-ide is sourced from PubChem (CID 162736215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).