2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid

C18H18N2O2 — CID 82356930

IUPAC2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
SMILESCCC(C)c1ccc(-c2cn3cc(C(=O)O)ccc3n2)cc1
InChIInChI=1S/C18H18N2O2/c1-3-12(2)13-4-6-14(7-5-13)16-11-20-10-15(18(21)22)8-9-17(20)19-16/h4-12H,3H2,1-2H3,(H,21,22)
InChIKeyOYWMNEXGTFVESN-UHFFFAOYSA-N
MW294.35 g/mol
LogP4.21
Rot. Bonds4

About 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid

2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid (PubChem CID 82356930) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
PubChem CID82356930
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
SMILESCCC(C)c1ccc(-c2cn3cc(C(=O)O)ccc3n2)cc1
InChIInChI=1S/C18H18N2O2/c1-3-12(2)13-4-6-14(7-5-13)16-11-20-10-15(18(21)22)8-9-17(20)19-16/h4-12H,3H2,1-2H3,(H,21,22)
InChIKeyOYWMNEXGTFVESN-UHFFFAOYSA-N
XLogP4.21
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 82357029
2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
CID 117128170
1-[2-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-6-yl]propan-1-one
CID 166038872
2-(4-butan-2-ylphenyl)quinoline-4-carboxylic acid
CID 3796863
4-(4-butan-2-ylbenzoyl)-6-(4-methylbenzoyl)benzene-1,3-dicarboxylic acid
CID 23586554
2-(4-methoxyphenyl)imidazo[1,2-a]pyridine-6-carbohydrazide
CID 3455990
3-(4-butan-2-ylphenyl)-4-methylbenzoic acid
CID 81476320
4-(2-propan-2-ylimidazo[1,2-a]pyridin-6-yl)benzoic acid
CID 82063352
acetic acid;4-[2-(4-carbamimidoylphenyl)imidazo[1,2-a]pyridin-6-yl]benzenecarboximidamide
CID 69254410
2-phenyl-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]imidazo[1,2-a]pyridine-6-carboxamide
CID 97198705
N-[(2R)-2-[ethyl(methyl)amino]butyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 97192179
N-[(2S)-2-hydroxy-2-(4-hydroxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-6-carboxamide
CID 96579471

Frequently Asked Questions

What is the IUPAC name of 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The IUPAC name of 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid (CID 82356930) is 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid.
What is the SMILES notation for 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The canonical SMILES for 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid is CCC(C)c1ccc(-c2cn3cc(C(=O)O)ccc3n2)cc1.
What is the InChIKey of 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The InChIKey is OYWMNEXGTFVESN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-3-12(2)13-4-6-14(7-5-13)16-11-20-10-15(18(21)22)8-9-17(20)19-16/h4-12H,3H2,1-2H3,(H,21,22).
What are the key properties of 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid has a molecular weight of 294.35 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid is sourced from PubChem (CID 82356930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).