2,4-dimethylimidazo[1,2-a]pyridin-4-ium

C9H11N2+ — CID 123855347

IUPAC2,4-dimethylimidazo[1,2-a]pyridin-4-ium
SMILESCC1=C[N+]2(C)C=CC=CC2=N1
InChIInChI=1S/C9H11N2/c1-8-7-11(2)6-4-3-5-9(11)10-8/h3-7H,1-2H3/q+1
InChIKeyFVUIJHAYJFDNLO-UHFFFAOYSA-N
MW147.20 g/mol
LogP1.79
Rot. Bonds

About 2,4-dimethylimidazo[1,2-a]pyridin-4-ium

2,4-dimethylimidazo[1,2-a]pyridin-4-ium (PubChem CID 123855347) has the molecular formula C9H11N2+ and a molecular weight of 147.20 g/mol. Its IUPAC name is 2,4-dimethylimidazo[1,2-a]pyridin-4-ium.

Molecular Properties

Compound Name2,4-dimethylimidazo[1,2-a]pyridin-4-ium
PubChem CID123855347
Molecular FormulaC9H11N2+
Molecular Weight147.20 g/mol
Exact Mass147.09
IUPAC Name2,4-dimethylimidazo[1,2-a]pyridin-4-ium
SMILESCC1=C[N+]2(C)C=CC=CC2=N1
InChIInChI=1S/C9H11N2/c1-8-7-11(2)6-4-3-5-9(11)10-8/h3-7H,1-2H3/q+1
InChIKeyFVUIJHAYJFDNLO-UHFFFAOYSA-N
XLogP1.79
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.20
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

2-Methyleneimidazo[1,2-a]pyridin-4-ium
CID 24198573
2h-Pyrido-[1,2-a]pyrimidine
CID 20222720
2H-imidazo[1,2-a]pyridin-4-ium
CID 23565484
Pyrido-[1,2-a]-1,3-diazepine
CID 129798958
1-ethenyl-5-fluoro-N-methylpyridin-2-imine
CID 68334595
4-Ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium
CID 69092720
4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine
CID 156652493
6-chloro-3H-imidazo[1,2-a]pyridin-3-ide;palladium(2+);prop-1-ene
CID 134856117
silver 3-methanidylidene-2H-imidazo[1,2-a]pyridine
CID 134859819
12,13-Diazatricyclo[6.4.1.04,13]trideca-1(12),2,4,6,8,10-hexaene
CID 135082435
(1-Methyl-2-pyridinylidene)cyanamide
CID 139235944
N-ethyl-[1,2,4]thiadiazolo[4,3-a]pyridin-3-imine
CID 168329087

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylimidazo[1,2-a]pyridin-4-ium?
The IUPAC name of 2,4-dimethylimidazo[1,2-a]pyridin-4-ium (CID 123855347) is 2,4-dimethylimidazo[1,2-a]pyridin-4-ium.
What is the SMILES notation for 2,4-dimethylimidazo[1,2-a]pyridin-4-ium?
The canonical SMILES for 2,4-dimethylimidazo[1,2-a]pyridin-4-ium is CC1=C[N+]2(C)C=CC=CC2=N1.
What is the InChIKey of 2,4-dimethylimidazo[1,2-a]pyridin-4-ium?
The InChIKey is FVUIJHAYJFDNLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N2/c1-8-7-11(2)6-4-3-5-9(11)10-8/h3-7H,1-2H3/q+1.
What are the key properties of 2,4-dimethylimidazo[1,2-a]pyridin-4-ium?
2,4-dimethylimidazo[1,2-a]pyridin-4-ium has a molecular weight of 147.20 g/mol, XLogP of 1.79, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylimidazo[1,2-a]pyridin-4-ium is sourced from PubChem (CID 123855347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).