(2E)-2-ethylidenepyridin-1-ide

C7H8N- — CID 58833494

IUPAC(2E)-2-ethylidenepyridin-1-ide
SMILESC/C=C1\C=CC=C[N-]1
InChIInChI=1S/C7H8N/c1-2-7-5-3-4-6-8-7/h2-6H,1H3/q-1/b7-2+
InChIKeyJPSQDZTWTTUFSC-FARCUNLSSA-N
MW106.15 g/mol
LogP2.35
Rot. Bonds

About (2E)-2-ethylidenepyridin-1-ide

(2E)-2-ethylidenepyridin-1-ide (PubChem CID 58833494) has the molecular formula C7H8N- and a molecular weight of 106.15 g/mol. Its IUPAC name is (2E)-2-ethylidenepyridin-1-ide.

Molecular Properties

Compound Name(2E)-2-ethylidenepyridin-1-ide
PubChem CID58833494
Molecular FormulaC7H8N-
Molecular Weight106.15 g/mol
Exact Mass106.07
IUPAC Name(2E)-2-ethylidenepyridin-1-ide
SMILESC/C=C1\C=CC=C[N-]1
InChIInChI=1S/C7H8N/c1-2-7-5-3-4-6-8-7/h2-6H,1H3/q-1/b7-2+
InChIKeyJPSQDZTWTTUFSC-FARCUNLSSA-N
XLogP2.35
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.15
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (2E)-2-ethylidenepyridin-1-ide?
The IUPAC name of (2E)-2-ethylidenepyridin-1-ide (CID 58833494) is (2E)-2-ethylidenepyridin-1-ide.
What is the SMILES notation for (2E)-2-ethylidenepyridin-1-ide?
The canonical SMILES for (2E)-2-ethylidenepyridin-1-ide is C/C=C1\C=CC=C[N-]1.
What is the InChIKey of (2E)-2-ethylidenepyridin-1-ide?
The InChIKey is JPSQDZTWTTUFSC-FARCUNLSSA-N. The full InChI is InChI=1S/C7H8N/c1-2-7-5-3-4-6-8-7/h2-6H,1H3/q-1/b7-2+.
What are the key properties of (2E)-2-ethylidenepyridin-1-ide?
(2E)-2-ethylidenepyridin-1-ide has a molecular weight of 106.15 g/mol, XLogP of 2.35, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-ethylidenepyridin-1-ide is sourced from PubChem (CID 58833494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).