3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid

C12H15N3O2 — CID 82355911

IUPAC3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid
SMILESCC(C)(C)c1nc2c(C(=O)O)cccn2c1N
InChIInChI=1S/C12H15N3O2/c1-12(2,3)8-9(13)15-6-4-5-7(11(16)17)10(15)14-8/h4-6H,13H2,1-3H3,(H,16,17)
InChIKeySEBZIQTVRGMARU-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.91
Rot. Bonds1

About 3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid

3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid (PubChem CID 82355911) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid
PubChem CID82355911
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid
SMILESCC(C)(C)c1nc2c(C(=O)O)cccn2c1N
InChIInChI=1S/C12H15N3O2/c1-12(2,3)8-9(13)15-6-4-5-7(11(16)17)10(15)14-8/h4-6H,13H2,1-3H3,(H,16,17)
InChIKeySEBZIQTVRGMARU-UHFFFAOYSA-N
XLogP1.91
TPSA80.62 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylic acid
CID 58074730
2-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82565546
3-amino-2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355928
3-amino-2-cyclohexylimidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355931
2-tert-butyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 79015469
3-amino-2-(3,4-difluorophenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355927
3-amino-2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridine-8-carboxylic acid
CID 82355906
3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride
CID 52983714
2-ethyl-3-nitroimidazo[1,2-a]pyridine-8-carboxylic acid
CID 83841739
3-nitroso-2-propan-2-ylimidazo[1,2-a]pyridine-8-carboxylic acid
CID 82356546
1-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-3-yl)-2-phenylethane-1,2-dione
CID 156700622
2-tert-butylpyridine-3-carboxylic acid
CID 20815660

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid?
The IUPAC name of 3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid (CID 82355911) is 3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid?
The canonical SMILES for 3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid is CC(C)(C)c1nc2c(C(=O)O)cccn2c1N.
What is the InChIKey of 3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid?
The InChIKey is SEBZIQTVRGMARU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-12(2,3)8-9(13)15-6-4-5-7(11(16)17)10(15)14-8/h4-6H,13H2,1-3H3,(H,16,17).
What are the key properties of 3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid?
3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid has a molecular weight of 233.27 g/mol, XLogP of 1.91, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-tert-butylimidazo[1,2-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 82355911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).