5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid

C9H7ClN2O2 — CID 130064894

IUPAC5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCc1cc(Cl)n2c(C(=O)O)cnc2c1
InChIInChI=1S/C9H7ClN2O2/c1-5-2-7(10)12-6(9(13)14)4-11-8(12)3-5/h2-4H,1H3,(H,13,14)
InChIKeyFKTWNEOKLBFISG-UHFFFAOYSA-N
MW210.62 g/mol
LogP1.99
Rot. Bonds1

About 5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid

5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 130064894) has the molecular formula C9H7ClN2O2 and a molecular weight of 210.62 g/mol. Its IUPAC name is 5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID130064894
Molecular FormulaC9H7ClN2O2
Molecular Weight210.62 g/mol
Exact Mass210.02
IUPAC Name5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCc1cc(Cl)n2c(C(=O)O)cnc2c1
InChIInChI=1S/C9H7ClN2O2/c1-5-2-7(10)12-6(9(13)14)4-11-8(12)3-5/h2-4H,1H3,(H,13,14)
InChIKeyFKTWNEOKLBFISG-UHFFFAOYSA-N
XLogP1.99
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.62
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 76849588
5-bromo-6-methylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 130064939
4-methoxy-2-methylimidazo[1,2-a][1,3,5]triazine-6-carboxylic acid
CID 84675823
7-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 55265824
6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 165459484
5-(carboxymethyl)-6-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 19701314
5-bromo-7-methoxyimidazo[1,2-a]pyridine-3-carboxamide;5-bromo-7-methoxyimidazo[1,2-a]pyridine-3-carboxylic acid
CID 167613235
5-aminoimidazo[1,2-a]pyridine-3-carboxylic acid
CID 19609393
6-methylimidazo[1,2-b]pyridazine-3-carboxylic acid
CID 116854345
5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane
CID 164920429
1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone
CID 13248805
6-(2,4-dimethylphenyl)imidazo[1,2-b]pyridazine-3-carboxylic acid
CID 116854355

Frequently Asked Questions

What is the IUPAC name of 5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid (CID 130064894) is 5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid is Cc1cc(Cl)n2c(C(=O)O)cnc2c1.
What is the InChIKey of 5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is FKTWNEOKLBFISG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2O2/c1-5-2-7(10)12-6(9(13)14)4-11-8(12)3-5/h2-4H,1H3,(H,13,14).
What are the key properties of 5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid?
5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 210.62 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 130064894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).