3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid

C11H11BrN2O2 — CID 82529860

IUPAC3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid
SMILESCc1nc2cc(Br)ccn2c1CCC(=O)O
InChIInChI=1S/C11H11BrN2O2/c1-7-9(2-3-11(15)16)14-5-4-8(12)6-10(14)13-7/h4-6H,2-3H2,1H3,(H,15,16)
InChIKeyVLAWMPNZAFQUBN-UHFFFAOYSA-N
MW283.12 g/mol
LogP2.42
Rot. Bonds3

About 3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid

3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid (PubChem CID 82529860) has the molecular formula C11H11BrN2O2 and a molecular weight of 283.12 g/mol. Its IUPAC name is 3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid.

Molecular Properties

Compound Name3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid
PubChem CID82529860
Molecular FormulaC11H11BrN2O2
Molecular Weight283.12 g/mol
Exact Mass282.00
IUPAC Name3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid
SMILESCc1nc2cc(Br)ccn2c1CCC(=O)O
InChIInChI=1S/C11H11BrN2O2/c1-7-9(2-3-11(15)16)14-5-4-8(12)6-10(14)13-7/h4-6H,2-3H2,1H3,(H,15,16)
InChIKeyVLAWMPNZAFQUBN-UHFFFAOYSA-N
XLogP2.42
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.12
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-bromo-2,3-dimethylimidazo[1,2-a]pyridine;ethane
CID 143862133
(7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol
CID 115044017
3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid
CID 84567691
3-amino-7-bromoimidazo[1,2-a]pyridine-2-carboxamide
CID 82530178
7-bromo-3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid
CID 166609430
7-bromo-2-methylimidazo[1,2-a]pyridine-3-carbothioamide
CID 82530100
3-(4-bromo-2-methylphenyl)propanoic acid
CID 69202839
3-[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanoic acid
CID 82035102
2,3-dimethylimidazo[1,2-a]pyridine-7-carboxylic acid
CID 53397324
3-(5-bromo-2-methylindazol-3-yl)propanoic acid
CID 84730630
3-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-(2,4,6-trimethylphenyl)propanamide
CID 84569535
3-[2-(3-bromoanilino)-5-methylphenyl]propanoic acid
CID 84609790

Frequently Asked Questions

What is the IUPAC name of 3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid?
The IUPAC name of 3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid (CID 82529860) is 3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid.
What is the SMILES notation for 3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid?
The canonical SMILES for 3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid is Cc1nc2cc(Br)ccn2c1CCC(=O)O.
What is the InChIKey of 3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid?
The InChIKey is VLAWMPNZAFQUBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2O2/c1-7-9(2-3-11(15)16)14-5-4-8(12)6-10(14)13-7/h4-6H,2-3H2,1H3,(H,15,16).
What are the key properties of 3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid?
3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid has a molecular weight of 283.12 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid is sourced from PubChem (CID 82529860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).