3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid

C15H13N3O3 — CID 155071727

IUPAC3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid
SMILESCOc1ncccc1-c1c(C)nc2cc(C(=O)O)ccn12
InChIInChI=1S/C15H13N3O3/c1-9-13(11-4-3-6-16-14(11)21-2)18-7-5-10(15(19)20)8-12(18)17-9/h3-8H,1-2H3,(H,19,20)
InChIKeyLHMCEJVEGQKTOY-UHFFFAOYSA-N
MW283.29 g/mol
LogP2.41
Rot. Bonds3

About 3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid

3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid (PubChem CID 155071727) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is 3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid
PubChem CID155071727
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC Name3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid
SMILESCOc1ncccc1-c1c(C)nc2cc(C(=O)O)ccn12
InChIInChI=1S/C15H13N3O3/c1-9-13(11-4-3-6-16-14(11)21-2)18-7-5-10(15(19)20)8-12(18)17-9/h3-8H,1-2H3,(H,19,20)
InChIKeyLHMCEJVEGQKTOY-UHFFFAOYSA-N
XLogP2.41
TPSA76.72 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid?
The IUPAC name of 3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid (CID 155071727) is 3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid.
What is the SMILES notation for 3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid?
The canonical SMILES for 3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid is COc1ncccc1-c1c(C)nc2cc(C(=O)O)ccn12.
What is the InChIKey of 3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid?
The InChIKey is LHMCEJVEGQKTOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c1-9-13(11-4-3-6-16-14(11)21-2)18-7-5-10(15(19)20)8-12(18)17-9/h3-8H,1-2H3,(H,19,20).
What are the key properties of 3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid?
3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid has a molecular weight of 283.29 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxy-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine-7-carboxylic acid is sourced from PubChem (CID 155071727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).