3-methylideneimidazo[1,2-a]pyridin-2-one

C8H6N2O — CID 22964329

IUPAC3-methylideneimidazo[1,2-a]pyridin-2-one
SMILESC=C1C(=O)N=C2C=CC=CN12
InChIInChI=1S/C8H6N2O/c1-6-8(11)9-7-4-2-3-5-10(6)7/h2-5H,1H2
InChIKeyRIPAFYBFOJDWNH-UHFFFAOYSA-N
MW146.15 g/mol
LogP0.82
Rot. Bonds

About 3-methylideneimidazo[1,2-a]pyridin-2-one

3-methylideneimidazo[1,2-a]pyridin-2-one (PubChem CID 22964329) has the molecular formula C8H6N2O and a molecular weight of 146.15 g/mol. Its IUPAC name is 3-methylideneimidazo[1,2-a]pyridin-2-one.

Molecular Properties

Compound Name3-methylideneimidazo[1,2-a]pyridin-2-one
PubChem CID22964329
Molecular FormulaC8H6N2O
Molecular Weight146.15 g/mol
Exact Mass146.05
IUPAC Name3-methylideneimidazo[1,2-a]pyridin-2-one
SMILESC=C1C(=O)N=C2C=CC=CN12
InChIInChI=1S/C8H6N2O/c1-6-8(11)9-7-4-2-3-5-10(6)7/h2-5H,1H2
InChIKeyRIPAFYBFOJDWNH-UHFFFAOYSA-N
XLogP0.82
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-methylideneimidazo[1,2-a]pyridin-2-one?
The IUPAC name of 3-methylideneimidazo[1,2-a]pyridin-2-one (CID 22964329) is 3-methylideneimidazo[1,2-a]pyridin-2-one.
What is the SMILES notation for 3-methylideneimidazo[1,2-a]pyridin-2-one?
The canonical SMILES for 3-methylideneimidazo[1,2-a]pyridin-2-one is C=C1C(=O)N=C2C=CC=CN12.
What is the InChIKey of 3-methylideneimidazo[1,2-a]pyridin-2-one?
The InChIKey is RIPAFYBFOJDWNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O/c1-6-8(11)9-7-4-2-3-5-10(6)7/h2-5H,1H2.
What are the key properties of 3-methylideneimidazo[1,2-a]pyridin-2-one?
3-methylideneimidazo[1,2-a]pyridin-2-one has a molecular weight of 146.15 g/mol, XLogP of 0.82, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylideneimidazo[1,2-a]pyridin-2-one is sourced from PubChem (CID 22964329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).