6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid

C12H11BrN2O2 — CID 83170033

IUPAC6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCc1cc(Br)cn2c(C(=O)O)c(C3CC3)nc12
InChIInChI=1S/C12H11BrN2O2/c1-6-4-8(13)5-15-10(12(16)17)9(7-2-3-7)14-11(6)15/h4-5,7H,2-3H2,1H3,(H,16,17)
InChIKeyRIEDZUWPAQAVTN-UHFFFAOYSA-N
MW295.14 g/mol
LogP2.98
Rot. Bonds2

About 6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid

6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 83170033) has the molecular formula C12H11BrN2O2 and a molecular weight of 295.14 g/mol. Its IUPAC name is 6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID83170033
Molecular FormulaC12H11BrN2O2
Molecular Weight295.14 g/mol
Exact Mass294.00
IUPAC Name6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCc1cc(Br)cn2c(C(=O)O)c(C3CC3)nc12
InChIInChI=1S/C12H11BrN2O2/c1-6-4-8(13)5-15-10(12(16)17)9(7-2-3-7)14-11(6)15/h4-5,7H,2-3H2,1H3,(H,16,17)
InChIKeyRIEDZUWPAQAVTN-UHFFFAOYSA-N
XLogP2.98
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.14
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid (CID 83170033) is 6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid is Cc1cc(Br)cn2c(C(=O)O)c(C3CC3)nc12.
What is the InChIKey of 6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is RIEDZUWPAQAVTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2O2/c1-6-4-8(13)5-15-10(12(16)17)9(7-2-3-7)14-11(6)15/h4-5,7H,2-3H2,1H3,(H,16,17).
What are the key properties of 6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid?
6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 295.14 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 83170033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).