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

C8H6N2O — CID 22964322

IUPAC2-methylideneimidazo[1,2-a]pyridin-3-one
SMILESC=C1N=C2C=CC=CN2C1=O
InChIInChI=1S/C8H6N2O/c1-6-8(11)10-5-3-2-4-7(10)9-6/h2-5H,1H2
InChIKeyRYMIJAFYMIYUHM-UHFFFAOYSA-N
MW146.15 g/mol
LogP0.82
Rot. Bonds

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

2-methylideneimidazo[1,2-a]pyridin-3-one (PubChem CID 22964322) has the molecular formula C8H6N2O and a molecular weight of 146.15 g/mol. Its IUPAC name is 2-methylideneimidazo[1,2-a]pyridin-3-one.

Molecular Properties

Compound Name2-methylideneimidazo[1,2-a]pyridin-3-one
PubChem CID22964322
Molecular FormulaC8H6N2O
Molecular Weight146.15 g/mol
Exact Mass146.05
IUPAC Name2-methylideneimidazo[1,2-a]pyridin-3-one
SMILESC=C1N=C2C=CC=CN2C1=O
InChIInChI=1S/C8H6N2O/c1-6-8(11)10-5-3-2-4-7(10)9-6/h2-5H,1H2
InChIKeyRYMIJAFYMIYUHM-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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Related Compounds

Imidazo(1,2-a)pyridin-2(3H)-one
CID 541778
3-Amino-4H-pyrido[1,2-a]pyrimidin-4-one
CID 3514055
Imidazo[1,2-a]pyridin-2(3H)-one hydrochloride
CID 12299252
Imidazo[1,2-A]pyridine-2,3-dione
CID 21205927
Imidazo[1,2-a]pyridin-3(2h)-one
CID 21794501
6H-pyrrolo[1,2-a]pyrimidin-4-one
CID 53640157
Pyrrolo[1,2-a]pyrimidin-6-one
CID 129873569
3-Amino-8-fluoropyrido[1,2-a]pyrimidin-4-one
CID 115015293
3-Amino-7-fluoropyrido[1,2-a]pyrimidin-4-one
CID 115015294
3-Amino-9-fluoropyrido[1,2-a]pyrimidin-4-one
CID 115015296
5-Methylimidazo[1,2-a]pyridin-2(3H)-one
CID 12299249
3-Methylideneimidazo[1,2-a]pyridin-2-one
CID 22964329

Frequently Asked Questions

What is the IUPAC name of 2-methylideneimidazo[1,2-a]pyridin-3-one?
The IUPAC name of 2-methylideneimidazo[1,2-a]pyridin-3-one (CID 22964322) is 2-methylideneimidazo[1,2-a]pyridin-3-one.
What is the SMILES notation for 2-methylideneimidazo[1,2-a]pyridin-3-one?
The canonical SMILES for 2-methylideneimidazo[1,2-a]pyridin-3-one is C=C1N=C2C=CC=CN2C1=O.
What is the InChIKey of 2-methylideneimidazo[1,2-a]pyridin-3-one?
The InChIKey is RYMIJAFYMIYUHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O/c1-6-8(11)10-5-3-2-4-7(10)9-6/h2-5H,1H2.
What are the key properties of 2-methylideneimidazo[1,2-a]pyridin-3-one?
2-methylideneimidazo[1,2-a]pyridin-3-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 2-methylideneimidazo[1,2-a]pyridin-3-one is sourced from PubChem (CID 22964322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).