4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid

C12H9N3O3 — CID 82373648

IUPAC4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid
SMILESCc1noc(C(=O)O)c1-c1cn2ccccc2n1
InChIInChI=1S/C12H9N3O3/c1-7-10(11(12(16)17)18-14-7)8-6-15-5-3-2-4-9(15)13-8/h2-6H,1H3,(H,16,17)
InChIKeyKVZFIQQQJKJCEZ-UHFFFAOYSA-N
MW243.22 g/mol
LogP2.00
Rot. Bonds2

About 4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid

4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid (PubChem CID 82373648) has the molecular formula C12H9N3O3 and a molecular weight of 243.22 g/mol. Its IUPAC name is 4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid.

Molecular Properties

Compound Name4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid
PubChem CID82373648
Molecular FormulaC12H9N3O3
Molecular Weight243.22 g/mol
Exact Mass243.06
IUPAC Name4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid
SMILESCc1noc(C(=O)O)c1-c1cn2ccccc2n1
InChIInChI=1S/C12H9N3O3/c1-7-10(11(12(16)17)18-14-7)8-6-15-5-3-2-4-9(15)13-8/h2-6H,1H3,(H,16,17)
InChIKeyKVZFIQQQJKJCEZ-UHFFFAOYSA-N
XLogP2.00
TPSA80.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.22
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid?
The IUPAC name of 4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid (CID 82373648) is 4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid.
What is the SMILES notation for 4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid?
The canonical SMILES for 4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid is Cc1noc(C(=O)O)c1-c1cn2ccccc2n1.
What is the InChIKey of 4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid?
The InChIKey is KVZFIQQQJKJCEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O3/c1-7-10(11(12(16)17)18-14-7)8-6-15-5-3-2-4-9(15)13-8/h2-6H,1H3,(H,16,17).
What are the key properties of 4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid?
4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid has a molecular weight of 243.22 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazo[1,2-a]pyridin-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid is sourced from PubChem (CID 82373648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).