3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid

C16H15N3O3 — CID 82356044

IUPAC3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
SMILESCOc1ccc(C)cc1-c1nc2ccc(C(=O)O)cn2c1N
InChIInChI=1S/C16H15N3O3/c1-9-3-5-12(22-2)11(7-9)14-15(17)19-8-10(16(20)21)4-6-13(19)18-14/h3-8H,17H2,1-2H3,(H,20,21)
InChIKeyXEXYZXAXNNRIRC-UHFFFAOYSA-N
MW297.31 g/mol
LogP2.60
Rot. Bonds3

About 3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid

3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid (PubChem CID 82356044) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is 3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
PubChem CID82356044
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC Name3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
SMILESCOc1ccc(C)cc1-c1nc2ccc(C(=O)O)cn2c1N
InChIInChI=1S/C16H15N3O3/c1-9-3-5-12(22-2)11(7-9)14-15(17)19-8-10(16(20)21)4-6-13(19)18-14/h3-8H,17H2,1-2H3,(H,20,21)
InChIKeyXEXYZXAXNNRIRC-UHFFFAOYSA-N
XLogP2.60
TPSA89.85 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-2-(4-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
CID 82356036
6-bromo-2-(5-bromo-2-methoxyphenyl)imidazo[1,2-a]pyridin-3-amine
CID 63618959
6-bromo-2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine
CID 63618087
[3-amino-2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridin-6-yl]methanol
CID 82356101
2-(5-chloro-2-methoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-amine
CID 82356161
4-(2-methoxy-5-methylphenyl)-1-methylimidazole-2-carboxylic acid
CID 82086061
2-methoxy-1-methyl-11-oxopyrido[2,1-b]quinazoline-8-carboxylic acid
CID 70549091
3-amino-5-(2-methoxy-5-methylphenyl)benzoic acid
CID 53226231
2-[2-(2-methoxy-5-methylphenyl)-6-nitroimidazo[1,2-a]pyridin-3-yl]ethanamine
CID 28866512
3-(2-methoxy-5-methylphenyl)-1H-indazole-6-carboxylic acid
CID 39218703
2-amino-6-(2-methoxy-5-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
CID 82555678
2-[2-(3,4-dimethoxyphenyl)ethenyl]-3-methyl-4-oxopyrido[1,2-a]pyrimidine-7-carboxylic acid
CID 56635057

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The IUPAC name of 3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid (CID 82356044) is 3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid.
What is the SMILES notation for 3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The canonical SMILES for 3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid is COc1ccc(C)cc1-c1nc2ccc(C(=O)O)cn2c1N.
What is the InChIKey of 3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The InChIKey is XEXYZXAXNNRIRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-9-3-5-12(22-2)11(7-9)14-15(17)19-8-10(16(20)21)4-6-13(19)18-14/h3-8H,17H2,1-2H3,(H,20,21).
What are the key properties of 3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid has a molecular weight of 297.31 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid is sourced from PubChem (CID 82356044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).