2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine

C12H9IN4 — CID 70825869

IUPAC2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine
SMILESCc1nccc(-c2c(I)nc3ccccn23)n1
InChIInChI=1S/C12H9IN4/c1-8-14-6-5-9(15-8)11-12(13)16-10-4-2-3-7-17(10)11/h2-7H,1H3
InChIKeyNARJXVYHKVJRAB-UHFFFAOYSA-N
MW336.14 g/mol
LogP2.70
Rot. Bonds1

About 2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine

2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine (PubChem CID 70825869) has the molecular formula C12H9IN4 and a molecular weight of 336.14 g/mol. Its IUPAC name is 2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine
PubChem CID70825869
Molecular FormulaC12H9IN4
Molecular Weight336.14 g/mol
Exact Mass335.99
IUPAC Name2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine
SMILESCc1nccc(-c2c(I)nc3ccccn23)n1
InChIInChI=1S/C12H9IN4/c1-8-14-6-5-9(15-8)11-12(13)16-10-4-2-3-7-17(10)11/h2-7H,1H3
InChIKeyNARJXVYHKVJRAB-UHFFFAOYSA-N
XLogP2.70
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.14
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-iodo-3-methylimidazo[1,2-a]pyridine
CID 126539861
N-(2-chlorophenyl)-4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine
CID 6539019
4-[2-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine
CID 58278215
4-(2-chloroimidazo[1,2-a]pyridin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-2-amine
CID 68778138
4-(3,5-diphenylphenyl)-2-methylpyrimidine
CID 129265272
carbanide;ethane;[4-[2-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]azanide;tungsten;yttrium
CID 159407397
6-(2-methylimidazo[1,2-a]pyridin-3-yl)-1H-pyrimidine-2-thione
CID 2745456
2-[2-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]pyrimidin-4-amine
CID 142794752
7-ethyl-2-(4-methylphenyl)-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine
CID 142198770
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-phenylpyrimidin-4-amine
CID 90177990
4-[4-[2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]aniline
CID 57438927
methyl 3-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoate
CID 59176943

Frequently Asked Questions

What is the IUPAC name of 2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine (CID 70825869) is 2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine is Cc1nccc(-c2c(I)nc3ccccn23)n1.
What is the InChIKey of 2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine?
The InChIKey is NARJXVYHKVJRAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9IN4/c1-8-14-6-5-9(15-8)11-12(13)16-10-4-2-3-7-17(10)11/h2-7H,1H3.
What are the key properties of 2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine?
2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine has a molecular weight of 336.14 g/mol, XLogP of 2.70, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodo-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 70825869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).