2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid

C14H11N3O3S — CID 43357240

IUPAC2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid
SMILESCc1cccc2nc(C(=O)Nc3sccc3C(=O)O)cn12
InChIInChI=1S/C14H11N3O3S/c1-8-3-2-4-11-15-10(7-17(8)11)12(18)16-13-9(14(19)20)5-6-21-13/h2-7H,1H3,(H,16,18)(H,19,20)
InChIKeyXWLFTBXCQPDKKK-UHFFFAOYSA-N
MW301.33 g/mol
LogP2.65
Rot. Bonds3

About 2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid

2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid (PubChem CID 43357240) has the molecular formula C14H11N3O3S and a molecular weight of 301.33 g/mol. Its IUPAC name is 2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid.

Molecular Properties

Compound Name2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid
PubChem CID43357240
Molecular FormulaC14H11N3O3S
Molecular Weight301.33 g/mol
Exact Mass301.05
IUPAC Name2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid
SMILESCc1cccc2nc(C(=O)Nc3sccc3C(=O)O)cn12
InChIInChI=1S/C14H11N3O3S/c1-8-3-2-4-11-15-10(7-17(8)11)12(18)16-13-9(14(19)20)5-6-21-13/h2-7H,1H3,(H,16,18)(H,19,20)
InChIKeyXWLFTBXCQPDKKK-UHFFFAOYSA-N
XLogP2.65
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.33
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid?
The IUPAC name of 2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid (CID 43357240) is 2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid.
What is the SMILES notation for 2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid?
The canonical SMILES for 2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid is Cc1cccc2nc(C(=O)Nc3sccc3C(=O)O)cn12.
What is the InChIKey of 2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid?
The InChIKey is XWLFTBXCQPDKKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O3S/c1-8-3-2-4-11-15-10(7-17(8)11)12(18)16-13-9(14(19)20)5-6-21-13/h2-7H,1H3,(H,16,18)(H,19,20).
What are the key properties of 2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid?
2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid has a molecular weight of 301.33 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid is sourced from PubChem (CID 43357240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).