3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid

C14H9F2N3O2 — CID 82355927

IUPAC3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
SMILESNc1c(-c2ccc(F)c(F)c2)nc2c(C(=O)O)cccn12
InChIInChI=1S/C14H9F2N3O2/c15-9-4-3-7(6-10(9)16)11-12(17)19-5-1-2-8(14(20)21)13(19)18-11/h1-6H,17H2,(H,20,21)
InChIKeyLPYKMFOPXYVPSA-UHFFFAOYSA-N
MW289.24 g/mol
LogP2.56
Rot. Bonds2

About 3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid

3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid (PubChem CID 82355927) has the molecular formula C14H9F2N3O2 and a molecular weight of 289.24 g/mol. Its IUPAC name is 3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
PubChem CID82355927
Molecular FormulaC14H9F2N3O2
Molecular Weight289.24 g/mol
Exact Mass289.07
IUPAC Name3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
SMILESNc1c(-c2ccc(F)c(F)c2)nc2c(C(=O)O)cccn12
InChIInChI=1S/C14H9F2N3O2/c15-9-4-3-7(6-10(9)16)11-12(17)19-5-1-2-8(14(20)21)13(19)18-11/h1-6H,17H2,(H,20,21)
InChIKeyLPYKMFOPXYVPSA-UHFFFAOYSA-N
XLogP2.56
TPSA80.62 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.24
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355906
3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355928
2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine
CID 103095072
3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride
CID 52983714
3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355911
2-(3-fluoro-4-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine
CID 63645866
[3-amino-2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanol
CID 82355992
3-amino-2-cyclohexylimidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355931
2-(3,4-difluorophenyl)quinoline-4-carboxylic acid
CID 4611633
2-amino-4-(3,4-difluorophenyl)-1H-imidazole-5-carboxylic acid
CID 82477054
6-(3,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid
CID 69038091
2-(3,4-dichlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine
CID 56687055

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
The IUPAC name of 3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid (CID 82355927) is 3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
The canonical SMILES for 3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid is Nc1c(-c2ccc(F)c(F)c2)nc2c(C(=O)O)cccn12.
What is the InChIKey of 3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
The InChIKey is LPYKMFOPXYVPSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F2N3O2/c15-9-4-3-7(6-10(9)16)11-12(17)19-5-1-2-8(14(20)21)13(19)18-11/h1-6H,17H2,(H,20,21).
What are the key properties of 3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid has a molecular weight of 289.24 g/mol, XLogP of 2.56, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 82355927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).