ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine

C12H14N2 — CID 175098861

IUPACethene;2-(1H-pyridin-2-ylidene)-1H-pyridine
SMILESC1=CNC(=C2C=CC=CN2)C=C1.C=C
InChIInChI=1S/C10H10N2.C2H4/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2/h1-8,11-12H;1-2H2
InChIKeyYBVCQOACTZPLBX-UHFFFAOYSA-N
MW186.26 g/mol
LogP2.35
Rot. Bonds

About ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine

ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine (PubChem CID 175098861) has the molecular formula C12H14N2 and a molecular weight of 186.26 g/mol. Its IUPAC name is ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine.

Molecular Properties

Compound Nameethene;2-(1H-pyridin-2-ylidene)-1H-pyridine
PubChem CID175098861
Molecular FormulaC12H14N2
Molecular Weight186.26 g/mol
Exact Mass186.12
IUPAC Nameethene;2-(1H-pyridin-2-ylidene)-1H-pyridine
SMILESC1=CNC(=C2C=CC=CN2)C=C1.C=C
InChIInChI=1S/C10H10N2.C2H4/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2/h1-8,11-12H;1-2H2
InChIKeyYBVCQOACTZPLBX-UHFFFAOYSA-N
XLogP2.35
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine?
The IUPAC name of ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine (CID 175098861) is ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine.
What is the SMILES notation for ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine?
The canonical SMILES for ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine is C1=CNC(=C2C=CC=CN2)C=C1.C=C.
What is the InChIKey of ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine?
The InChIKey is YBVCQOACTZPLBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2.C2H4/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2/h1-8,11-12H;1-2H2.
What are the key properties of ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine?
ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine has a molecular weight of 186.26 g/mol, XLogP of 2.35, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine is sourced from PubChem (CID 175098861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).