8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid

C8H5BrN2O2 — CID 71695317

IUPAC8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid
SMILESO=C(O)c1cc(Br)c2nccn2c1
InChIInChI=1S/C8H5BrN2O2/c9-6-3-5(8(12)13)4-11-2-1-10-7(6)11/h1-4H,(H,12,13)
InChIKeyVVZFQMHWQNIOKK-UHFFFAOYSA-N
MW241.04 g/mol
LogP1.79
Rot. Bonds1

About 8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid

8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid (PubChem CID 71695317) has the molecular formula C8H5BrN2O2 and a molecular weight of 241.04 g/mol. Its IUPAC name is 8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid
PubChem CID71695317
Molecular FormulaC8H5BrN2O2
Molecular Weight241.04 g/mol
Exact Mass239.95
IUPAC Name8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid
SMILESO=C(O)c1cc(Br)c2nccn2c1
InChIInChI=1S/C8H5BrN2O2/c9-6-3-5(8(12)13)4-11-2-1-10-7(6)11/h1-4H,(H,12,13)
InChIKeyVVZFQMHWQNIOKK-UHFFFAOYSA-N
XLogP1.79
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.04
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Imidazo[1,2-a]pyridine-8-carboxylic acid
CID 11715357
(1,2,3,4)Tetrazolo(1,5-a)pyridine-8-carboxylic acid
CID 346464
6-Bromo-8-methylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 5260648
6-Bromo-2-methylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 12872599
Imidazo[1,2-a]pyridine-7-carboxylic acid
CID 18364844
[1,2,4]Triazolo[1,5-a]pyridine-6-carboxylic acid
CID 23438842
3-Methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid
CID 27375767
(1,2,3,4)Tetrazolo(1,5-a)pyridine-6-carboxylic acid
CID 346463
2-(1H-pyrrol-1-yl)pyridine-3-carboxylic acid
CID 63653570
2-[(6-Bromoimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]pyridine-3-carboxylic acid
CID 4225516
Methyl 2-(3-bromophenyl)-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine-6-carboxylate
CID 53299403
Methyl 3-benzyl-2-(3-bromophenyl)imidazo[1,2-a]pyridine-6-carboxylate
CID 53299413

Frequently Asked Questions

What is the IUPAC name of 8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid?
The IUPAC name of 8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid (CID 71695317) is 8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid.
What is the SMILES notation for 8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid?
The canonical SMILES for 8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid is O=C(O)c1cc(Br)c2nccn2c1.
What is the InChIKey of 8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid?
The InChIKey is VVZFQMHWQNIOKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5BrN2O2/c9-6-3-5(8(12)13)4-11-2-1-10-7(6)11/h1-4H,(H,12,13).
What are the key properties of 8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid?
8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid has a molecular weight of 241.04 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromoimidazo[1,2-a]pyridine-6-carboxylic acid is sourced from PubChem (CID 71695317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).