3-ethenyl-2H-pyridin-2-ide

C7H6N- — CID 150019446

IUPAC3-ethenyl-2H-pyridin-2-ide
SMILESC=Cc1[c-]nccc1
InChIInChI=1S/C7H6N/c1-2-7-4-3-5-8-6-7/h2-5H,1H2/q-1
InChIKeyDEYRVOMXRYPRJJ-UHFFFAOYSA-N
MW104.13 g/mol
LogP1.52
Rot. Bonds1

About 3-ethenyl-2H-pyridin-2-ide

3-ethenyl-2H-pyridin-2-ide (PubChem CID 150019446) has the molecular formula C7H6N- and a molecular weight of 104.13 g/mol. Its IUPAC name is 3-ethenyl-2H-pyridin-2-ide.

Molecular Properties

Compound Name3-ethenyl-2H-pyridin-2-ide
PubChem CID150019446
Molecular FormulaC7H6N-
Molecular Weight104.13 g/mol
Exact Mass104.05
IUPAC Name3-ethenyl-2H-pyridin-2-ide
SMILESC=Cc1[c-]nccc1
InChIInChI=1S/C7H6N/c1-2-7-4-3-5-8-6-7/h2-5H,1H2/q-1
InChIKeyDEYRVOMXRYPRJJ-UHFFFAOYSA-N
XLogP1.52
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.13
LogP ≤ 51.52
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

Bromozinc(1+) 3-methylpyridin-2-ide
CID 16133065
2,3-Dihydropyridine
CID 13347754
Lithium 5-methylpyridin-2-ide
CID 15815864
3-(Trifluoromethyl)pyridyllithium
CID 85826287
potassium 3-(trifluoromethyl)-2H-pyridin-2-ide
CID 135082422
5-Methyl-2-pyridylzinc bromide
CID 6411545
Benzazocine
CID 19879720
3Benzazetine
CID 21909720
3-Methylenepyridine
CID 59803326
3-Methanidylidenepyridin-1-ium
CID 59909632
Bis(carbene)pyridine
CID 59931162
2,5-Dimethylene-2,5-dihydropyridine
CID 76588966

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-2H-pyridin-2-ide?
The IUPAC name of 3-ethenyl-2H-pyridin-2-ide (CID 150019446) is 3-ethenyl-2H-pyridin-2-ide.
What is the SMILES notation for 3-ethenyl-2H-pyridin-2-ide?
The canonical SMILES for 3-ethenyl-2H-pyridin-2-ide is C=Cc1[c-]nccc1.
What is the InChIKey of 3-ethenyl-2H-pyridin-2-ide?
The InChIKey is DEYRVOMXRYPRJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N/c1-2-7-4-3-5-8-6-7/h2-5H,1H2/q-1.
What are the key properties of 3-ethenyl-2H-pyridin-2-ide?
3-ethenyl-2H-pyridin-2-ide has a molecular weight of 104.13 g/mol, XLogP of 1.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-2H-pyridin-2-ide is sourced from PubChem (CID 150019446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).