3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid

C16H15N3O2 — CID 82355928

IUPAC3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
SMILESCc1ccc(C)c(-c2nc3c(C(=O)O)cccn3c2N)c1
InChIInChI=1S/C16H15N3O2/c1-9-5-6-10(2)12(8-9)13-14(17)19-7-3-4-11(16(20)21)15(19)18-13/h3-8H,17H2,1-2H3,(H,20,21)
InChIKeyYHEJKWFINKYWQF-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.90
Rot. Bonds2

About 3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid

3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid (PubChem CID 82355928) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is 3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
PubChem CID82355928
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC Name3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
SMILESCc1ccc(C)c(-c2nc3c(C(=O)O)cccn3c2N)c1
InChIInChI=1S/C16H15N3O2/c1-9-5-6-10(2)12(8-9)13-14(17)19-7-3-4-11(16(20)21)15(19)18-13/h3-8H,17H2,1-2H3,(H,20,21)
InChIKeyYHEJKWFINKYWQF-UHFFFAOYSA-N
XLogP2.90
TPSA80.62 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.90
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-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355927
3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355911
3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride
CID 52983714
8-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 63616942
3-(2,5-dimethylphenyl)-1-methylpyrazole-4-carboxylic acid
CID 43141377
8-methyl-2-(2,4,6-trimethylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 63617283
3-amino-2-cyclohexylimidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355931
4-amino-2-(2,5-dimethylphenyl)benzoic acid
CID 82292983
methyl 3-amino-2-(2-methylphenyl)imidazo[2,1-a]isoquinoline-7-carboxylate
CID 18691240
2-(2,4-difluorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine
CID 63616783
1-bromo-3-(3-methylphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 84609069

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
The IUPAC name of 3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid (CID 82355928) is 3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
The canonical SMILES for 3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid is Cc1ccc(C)c(-c2nc3c(C(=O)O)cccn3c2N)c1.
What is the InChIKey of 3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
The InChIKey is YHEJKWFINKYWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-9-5-6-10(2)12(8-9)13-14(17)19-7-3-4-11(16(20)21)15(19)18-13/h3-8H,17H2,1-2H3,(H,20,21).
What are the key properties of 3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid has a molecular weight of 281.32 g/mol, XLogP of 2.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 82355928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).