6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid

C108H92ClFN14O13S2 — CID 162075278

IUPAC6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid
SMILESCOc1cccc(CCc2ccc3nccn3c2C(=O)O)c1.Cc1cc(CCc2ccc3nccn3c2C(=O)O)ccc1F.Cc1cccc(CCc2ccc3nccn3c2C(=O)O)c1Cl.O=C(O)c1c(CCc2ccc(-c3cccs3)cc2)ccc2nccn12.O=C(O)c1c(CCc2ccc3sccc3c2)ccc2nccn12.O=C(O)c1c(CCc2ccccc2-n2cccn2)ccc2nccn12
InChIInChI=1S/C20H16N2O2S.C19H16N4O2.C18H14N2O2S.C17H15ClN2O2.C17H15FN2O2.C17H16N2O3/c23-20(24)19-16(9-10-18-21-11-12-22(18)19)8-5-14-3-6-15(7-4-14)17-2-1-13-25-17;24-19(25)18-15(8-9-17-20-11-13-22(17)18)7-6-14-4-1-2-5-16(14)23-12-3-10-21-23;21-18(22)17-13(4-6-16-19-8-9-20(16)17)3-1-12-2-5-15-14(11-12)7-10-23-15;1-11-3-2-4-12(15(11)18)5-6-13-7-8-14-19-9-10-20(14)16(13)17(21)22;1-11-10-12(3-6-14(11)18)2-4-13-5-7-15-19-8-9-20(15)16(13)17(21)22;1-22-14-4-2-3-12(11-14)5-6-13-7-8-15-18-9-10-19(15)16(13)17(20)21/h1-4,6-7,9-13H,5,8H2,(H,23,24);1-5,8-13H,6-7H2,(H,24,25);2,4-11H,1,3H2,(H,21,22);2-4,7-10H,5-6H2,1H3,(H,21,22);3,5-10H,2,4H2,1H3,(H,21,22);2-4,7-11H,5-6H2,1H3,(H,20,21)
InChIKeyZBPWFNICFYFBFG-UHFFFAOYSA-N
MW1912.59 g/mol
LogP21.45
Rot. Bonds27

About 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid

6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid (PubChem CID 162075278) has the molecular formula C108H92ClFN14O13S2 and a molecular weight of 1912.59 g/mol. Its IUPAC name is 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid
PubChem CID162075278
Molecular FormulaC108H92ClFN14O13S2
Molecular Weight1912.59 g/mol
Exact Mass1910.61
IUPAC Name6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid
SMILESCOc1cccc(CCc2ccc3nccn3c2C(=O)O)c1.Cc1cc(CCc2ccc3nccn3c2C(=O)O)ccc1F.Cc1cccc(CCc2ccc3nccn3c2C(=O)O)c1Cl.O=C(O)c1c(CCc2ccc(-c3cccs3)cc2)ccc2nccn12.O=C(O)c1c(CCc2ccc3sccc3c2)ccc2nccn12.O=C(O)c1c(CCc2ccccc2-n2cccn2)ccc2nccn12
InChIInChI=1S/C20H16N2O2S.C19H16N4O2.C18H14N2O2S.C17H15ClN2O2.C17H15FN2O2.C17H16N2O3/c23-20(24)19-16(9-10-18-21-11-12-22(18)19)8-5-14-3-6-15(7-4-14)17-2-1-13-25-17;24-19(25)18-15(8-9-17-20-11-13-22(17)18)7-6-14-4-1-2-5-16(14)23-12-3-10-21-23;21-18(22)17-13(4-6-16-19-8-9-20(16)17)3-1-12-2-5-15-14(11-12)7-10-23-15;1-11-3-2-4-12(15(11)18)5-6-13-7-8-14-19-9-10-20(14)16(13)17(21)22;1-11-10-12(3-6-14(11)18)2-4-13-5-7-15-19-8-9-20(15)16(13)17(21)22;1-22-14-4-2-3-12(11-14)5-6-13-7-8-15-18-9-10-19(15)16(13)17(20)21/h1-4,6-7,9-13H,5,8H2,(H,23,24);1-5,8-13H,6-7H2,(H,24,25);2,4-11H,1,3H2,(H,21,22);2-4,7-10H,5-6H2,1H3,(H,21,22);3,5-10H,2,4H2,1H3,(H,21,22);2-4,7-11H,5-6H2,1H3,(H,20,21)
InChIKeyZBPWFNICFYFBFG-UHFFFAOYSA-N
XLogP21.45
TPSA354.65 Ų
H-Bond Donors6
H-Bond Acceptors23
Rotatable Bonds27
Heavy Atoms139
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001912.59
LogP ≤ 521.45
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1023

Analyze 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid with MolForge

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Related Compounds

(2R)-2-[(3S,4S)-3-[[4-(4-benzyl-2-ethylimidazol-1-yl)piperidin-1-yl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3,3-dimethylbutanoic acid;(2R)-2-[(3S,4S)-3-[[4-(5-benzyl-3-pyridinyl)piperidin-1-yl]methyl]-4-(3-methylphenyl)pyrrolidin-1-yl]-3,3-dimethylbutanoic acid;(2R)-2-[(3S,4S)-3-[[4-(6-chloroimidazo[1,2-a]pyridin-3-yl)piperidin-1-yl]methyl]-4-(3-methylphenyl)pyrrolidin-1-yl]-3-cyclobutylpropanoic acid;(2R)-2-[(3S,4S)-3-[[4-[3-[(4-cyanophenyl)methyl]-1-ethylpyrazol-5-yl]piperidin-1-yl]methyl]-4-(3-methylphenyl)pyrrolidin-1-yl]-3,3-dimethylbutanoic acid;(2R)-2-[(3S,4S)-3-[[4-[1-ethyl-3-[(4-methoxyphenyl)methyl]pyrazol-5-yl]piperidin-1-yl]methyl]-4-(3-methylphenyl)pyrrolidin-1-yl]-3,3-dimethylbutanoic acid;(2R)-2-[(3S,4S)-3-[[4-[1-ethyl-3-[(4-methylsulfonylphenyl)methyl]pyrazol-5-yl]piperidin-1-yl]methyl]-4-(3-methylphenyl)pyrrolidin-1-yl]-3,3-dimethylbutanoic acid
CID 158721857
6-[2-(2-Chlorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2,6-difluoro-3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-ethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylsulfonylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 159496399
[4-[4-amino-5-(7-chloro-1H-indol-2-yl)imidazo[5,1-f][1,2,4]triazin-7-yl]piperidin-1-yl]-thiophen-3-ylmethanone;4-[8-amino-1-(7-ethyl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-[8-amino-1-(7-methoxy-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;N-[[4-[8-amino-1-(7-methoxy-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide
CID 160459713
6-[2-(5-Chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 160885975

Frequently Asked Questions

What is the IUPAC name of 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
The IUPAC name of 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid (CID 162075278) is 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid.
What is the SMILES notation for 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
The canonical SMILES for 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid is COc1cccc(CCc2ccc3nccn3c2C(=O)O)c1.Cc1cc(CCc2ccc3nccn3c2C(=O)O)ccc1F.Cc1cccc(CCc2ccc3nccn3c2C(=O)O)c1Cl.O=C(O)c1c(CCc2ccc(-c3cccs3)cc2)ccc2nccn12.O=C(O)c1c(CCc2ccc3sccc3c2)ccc2nccn12.O=C(O)c1c(CCc2ccccc2-n2cccn2)ccc2nccn12.
What is the InChIKey of 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
The InChIKey is ZBPWFNICFYFBFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2S.C19H16N4O2.C18H14N2O2S.C17H15ClN2O2.C17H15FN2O2.C17H16N2O3/c23-20(24)19-16(9-10-18-21-11-12-22(18)19)8-5-14-3-6-15(7-4-14)17-2-1-13-25-17;24-19(25)18-15(8-9-17-20-11-13-22(17)18)7-6-14-4-1-2-5-16(14)23-12-3-10-21-23;21-18(22)17-13(4-6-16-19-8-9-20(16)17)3-1-12-2-5-15-14(11-12)7-10-23-15;1-11-3-2-4-12(15(11)18)5-6-13-7-8-14-19-9-10-20(14)16(13)17(21)22;1-11-10-12(3-6-14(11)18)2-4-13-5-7-15-19-8-9-20(15)16(13)17(21)22;1-22-14-4-2-3-12(11-14)5-6-13-7-8-15-18-9-10-19(15)16(13)17(20)21/h1-4,6-7,9-13H,5,8H2,(H,23,24);1-5,8-13H,6-7H2,(H,24,25);2,4-11H,1,3H2,(H,21,22);2-4,7-10H,5-6H2,1H3,(H,21,22);3,5-10H,2,4H2,1H3,(H,21,22);2-4,7-11H,5-6H2,1H3,(H,20,21).
What are the key properties of 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid has a molecular weight of 1912.59 g/mol, XLogP of 21.45, 27 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(1-benzothiophen-5-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-chloro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-thiophen-2-ylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid is sourced from PubChem (CID 162075278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).