4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid

C19H20N2O2 — CID 93211518

IUPAC4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid
SMILESCc1cc(-c2ccc(C(=O)O)cc2)cn2cc(C(C)(C)C)nc12
InChIInChI=1S/C19H20N2O2/c1-12-9-15(13-5-7-14(8-6-13)18(22)23)10-21-11-16(19(2,3)4)20-17(12)21/h5-11H,1-4H3,(H,22,23)
InChIKeyFFUZDROILKRHNR-UHFFFAOYSA-N
MW308.38 g/mol
LogP4.31
Rot. Bonds2

About 4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid

4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid (PubChem CID 93211518) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid.

Molecular Properties

Compound Name4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid
PubChem CID93211518
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid
SMILESCc1cc(-c2ccc(C(=O)O)cc2)cn2cc(C(C)(C)C)nc12
InChIInChI=1S/C19H20N2O2/c1-12-9-15(13-5-7-14(8-6-13)18(22)23)10-21-11-16(19(2,3)4)20-17(12)21/h5-11H,1-4H3,(H,22,23)
InChIKeyFFUZDROILKRHNR-UHFFFAOYSA-N
XLogP4.31
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,8-dimethylimidazo[1,2-a]pyridin-6-yl)benzoic acid
CID 82063350
2,8-dimethylimidazo[1,2-a]pyridine-6-carboxylic acid
CID 83967374
CID 158355468
CID 158355468
4-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)benzoic acid
CID 164581256
4-(4-hydroxy-3-methylphenyl)benzoic acid
CID 15389812
cobalt;methane;4-methylbenzoic acid;terephthalic acid;1,4-xylene
CID 158793119
4-(4-amino-3-methylphenyl)benzoic acid
CID 23005198
4-[4-[2-(3,4-dimethoxyphenyl)-8-methylimidazo[1,2-a]pyridin-6-yl]phenyl]piperazine-1-carboxylic acid
CID 175411485
2-tert-butylimidazo[1,2-a]pyrazine-8-carboxylic acid
CID 63260372
4-[2,5-dimethyl-4-(4-methylphenyl)phenyl]benzoic acid
CID 154692263
4-[4-(4-methylphenyl)-6-phenyl-2-pyridinyl]benzoic acid
CID 54333176
sodium 4-methylbenzoic acid
CID 164511663

Frequently Asked Questions

What is the IUPAC name of 4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid?
The IUPAC name of 4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid (CID 93211518) is 4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid.
What is the SMILES notation for 4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid?
The canonical SMILES for 4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid is Cc1cc(-c2ccc(C(=O)O)cc2)cn2cc(C(C)(C)C)nc12.
What is the InChIKey of 4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid?
The InChIKey is FFUZDROILKRHNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-12-9-15(13-5-7-14(8-6-13)18(22)23)10-21-11-16(19(2,3)4)20-17(12)21/h5-11H,1-4H3,(H,22,23).
What are the key properties of 4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid?
4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid has a molecular weight of 308.38 g/mol, XLogP of 4.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid is sourced from PubChem (CID 93211518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).