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

C16H15N3O3 — CID 82355906

IUPAC3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
SMILESCOc1ccc(-c2nc3c(C(=O)O)cccn3c2N)cc1C
InChIInChI=1S/C16H15N3O3/c1-9-8-10(5-6-12(9)22-2)13-14(17)19-7-3-4-11(16(20)21)15(19)18-13/h3-8H,17H2,1-2H3,(H,20,21)
InChIKeyDUSQWKISIIMUKE-UHFFFAOYSA-N
MW297.31 g/mol
LogP2.60
Rot. Bonds3

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

3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid (PubChem CID 82355906) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is 3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
PubChem CID82355906
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC Name3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
SMILESCOc1ccc(-c2nc3c(C(=O)O)cccn3c2N)cc1C
InChIInChI=1S/C16H15N3O3/c1-9-8-10(5-6-12(9)22-2)13-14(17)19-7-3-4-11(16(20)21)15(19)18-13/h3-8H,17H2,1-2H3,(H,20,21)
InChIKeyDUSQWKISIIMUKE-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

2-(3,4-dimethylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine
CID 63617301
3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355927
3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355928
2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine
CID 66480092
2-(3-fluoro-4-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine
CID 63645866
1-[2-(4-methoxy-3-methylphenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]ethanol
CID 82029446
[3-amino-2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanol
CID 82355992
3-(chloromethyl)-2-(4-methoxy-3-methylphenyl)-8-methylimidazo[1,2-a]pyridine
CID 39126375
2-methoxy-3-(4-methoxy-3-methylphenyl)benzoic acid
CID 53226287
2-amino-4-(4-methoxy-3-methylphenyl)-1,3-thiazole-5-carboxylic acid
CID 82133572
3-(4-methoxy-3-methylphenyl)-1,2-oxazole-4-carboxylic acid
CID 82390150
3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride
CID 52983714

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
The IUPAC name of 3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid (CID 82355906) is 3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
The canonical SMILES for 3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid is COc1ccc(-c2nc3c(C(=O)O)cccn3c2N)cc1C.
What is the InChIKey of 3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
The InChIKey is DUSQWKISIIMUKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-9-8-10(5-6-12(9)22-2)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-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid?
3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-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-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 82355906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).