3H-imidazo[1,2-a]pyridin-2-ylidenemethanone

C8H6N2O — CID 154109914

IUPAC3H-imidazo[1,2-a]pyridin-2-ylidenemethanone
SMILESO=C=C1CN2C=CC=CC2=N1
InChIInChI=1S/C8H6N2O/c11-6-7-5-10-4-2-1-3-8(10)9-7/h1-4H,5H2
InChIKeyHLDHHJRSTIHUIJ-UHFFFAOYSA-N
MW146.15 g/mol
LogP0.50
Rot. Bonds

About 3H-imidazo[1,2-a]pyridin-2-ylidenemethanone

3H-imidazo[1,2-a]pyridin-2-ylidenemethanone (PubChem CID 154109914) has the molecular formula C8H6N2O and a molecular weight of 146.15 g/mol. Its IUPAC name is 3H-imidazo[1,2-a]pyridin-2-ylidenemethanone.

Molecular Properties

Compound Name3H-imidazo[1,2-a]pyridin-2-ylidenemethanone
PubChem CID154109914
Molecular FormulaC8H6N2O
Molecular Weight146.15 g/mol
Exact Mass146.05
IUPAC Name3H-imidazo[1,2-a]pyridin-2-ylidenemethanone
SMILESO=C=C1CN2C=CC=CC2=N1
InChIInChI=1S/C8H6N2O/c11-6-7-5-10-4-2-1-3-8(10)9-7/h1-4H,5H2
InChIKeyHLDHHJRSTIHUIJ-UHFFFAOYSA-N
XLogP0.50
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 50.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3H-imidazo[1,2-a]pyridin-2-ylidenemethanone?
The IUPAC name of 3H-imidazo[1,2-a]pyridin-2-ylidenemethanone (CID 154109914) is 3H-imidazo[1,2-a]pyridin-2-ylidenemethanone.
What is the SMILES notation for 3H-imidazo[1,2-a]pyridin-2-ylidenemethanone?
The canonical SMILES for 3H-imidazo[1,2-a]pyridin-2-ylidenemethanone is O=C=C1CN2C=CC=CC2=N1.
What is the InChIKey of 3H-imidazo[1,2-a]pyridin-2-ylidenemethanone?
The InChIKey is HLDHHJRSTIHUIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O/c11-6-7-5-10-4-2-1-3-8(10)9-7/h1-4H,5H2.
What are the key properties of 3H-imidazo[1,2-a]pyridin-2-ylidenemethanone?
3H-imidazo[1,2-a]pyridin-2-ylidenemethanone has a molecular weight of 146.15 g/mol, XLogP of 0.50, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3H-imidazo[1,2-a]pyridin-2-ylidenemethanone is sourced from PubChem (CID 154109914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).