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

C103H95ClF2N12O16S — CID 159496399

IUPAC6-[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
SMILESCCc1ccccc1CCc1ccc2nccn2c1C(=O)O.COc1c(C)cccc1CCc1ccc2nccn2c1C(=O)O.COc1ccc(F)c(CCc2ccc3nccn3c2C(=O)O)c1F.CS(=O)(=O)c1cccc(CCc2ccc3nccn3c2C(=O)O)c1.Cc1ccc(CCc2ccc3nccn3c2C(=O)O)cc1.O=C(O)c1c(CCc2ccccc2Cl)ccc2nccn12
InChIInChI=1S/C18H18N2O3.C18H18N2O2.C17H14F2N2O3.C17H16N2O4S.C17H16N2O2.C16H13ClN2O2/c1-12-4-3-5-14(17(12)23-2)7-6-13-8-9-15-19-10-11-20(15)16(13)18(21)22;1-2-13-5-3-4-6-14(13)7-8-15-9-10-16-19-11-12-20(16)17(15)18(21)22;1-24-13-6-5-12(18)11(15(13)19)4-2-10-3-7-14-20-8-9-21(14)16(10)17(22)23;1-24(22,23)14-4-2-3-12(11-14)5-6-13-7-8-15-18-9-10-19(15)16(13)17(20)21;1-12-2-4-13(5-3-12)6-7-14-8-9-15-18-10-11-19(15)16(14)17(20)21;17-13-4-2-1-3-11(13)5-6-12-7-8-14-18-9-10-19(14)15(12)16(20)21/h3-5,8-11H,6-7H2,1-2H3,(H,21,22);3-6,9-12H,2,7-8H2,1H3,(H,21,22);3,5-9H,2,4H2,1H3,(H,22,23);2-4,7-11H,5-6H2,1H3,(H,20,21);2-5,8-11H,6-7H2,1H3,(H,20,21);1-4,7-10H,5-6H2,(H,20,21)
InChIKeyLYVLKAXXQGIQOZ-UHFFFAOYSA-N
MW1862.48 g/mol
LogP18.44
Rot. Bonds28

About 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

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 (PubChem CID 159496399) has the molecular formula C103H95ClF2N12O16S and a molecular weight of 1862.48 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name6-[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
PubChem CID159496399
Molecular FormulaC103H95ClF2N12O16S
Molecular Weight1862.48 g/mol
Exact Mass1860.64
IUPAC Name6-[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
SMILESCCc1ccccc1CCc1ccc2nccn2c1C(=O)O.COc1c(C)cccc1CCc1ccc2nccn2c1C(=O)O.COc1ccc(F)c(CCc2ccc3nccn3c2C(=O)O)c1F.CS(=O)(=O)c1cccc(CCc2ccc3nccn3c2C(=O)O)c1.Cc1ccc(CCc2ccc3nccn3c2C(=O)O)cc1.O=C(O)c1c(CCc2ccccc2Cl)ccc2nccn12
InChIInChI=1S/C18H18N2O3.C18H18N2O2.C17H14F2N2O3.C17H16N2O4S.C17H16N2O2.C16H13ClN2O2/c1-12-4-3-5-14(17(12)23-2)7-6-13-8-9-15-19-10-11-20(15)16(13)18(21)22;1-2-13-5-3-4-6-14(13)7-8-15-9-10-16-19-11-12-20(16)17(15)18(21)22;1-24-13-6-5-12(18)11(15(13)19)4-2-10-3-7-14-20-8-9-21(14)16(10)17(22)23;1-24(22,23)14-4-2-3-12(11-14)5-6-13-7-8-15-18-9-10-19(15)16(13)17(20)21;1-12-2-4-13(5-3-12)6-7-14-8-9-15-18-10-11-19(15)16(14)17(20)21;17-13-4-2-1-3-11(13)5-6-12-7-8-14-18-9-10-19(14)15(12)16(20)21/h3-5,8-11H,6-7H2,1-2H3,(H,21,22);3-6,9-12H,2,7-8H2,1H3,(H,21,22);3,5-9H,2,4H2,1H3,(H,22,23);2-4,7-11H,5-6H2,1H3,(H,20,21);2-5,8-11H,6-7H2,1H3,(H,20,21);1-4,7-10H,5-6H2,(H,20,21)
InChIKeyLYVLKAXXQGIQOZ-UHFFFAOYSA-N
XLogP18.44
TPSA380.20 Ų
H-Bond Donors6
H-Bond Acceptors22
Rotatable Bonds28
Heavy Atoms135
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001862.48
LogP ≤ 518.44
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1022

Analyze 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 with MolForge

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Related Compounds

6-[2-(6-chloro-2-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 159553520
1-chloro-2-[(2-fluoro-5-methylphenoxy)methyl]-3-methoxybenzene
CID 144860819
6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 161094919
1-(benzenesulfonyl)-2-[4-[(2,5-dimethylphenyl)methoxy]-3-methoxyphenyl]imidazole
CID 110529999
1-ethyl-2-[(2-fluoro-5-methylphenoxy)methyl]-3-methoxybenzene;methyl formate
CID 144933730
3-[4-(3-ethylphenyl)sulfonylphenyl]-1-imidazo[1,2-a]pyridin-6-ylpropan-1-one
CID 160997514
2-O-tert-butyl 1-O-methyl (1R)-6-[(2-chlorophenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,6-dichlorophenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-fluoro-3-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-fluoro-4-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(4-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate
CID 158369870
benzyl N-[1-[[8-[(2,6-difluoro-3-methoxyphenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carbonyl]amino]-2-methylbutan-2-yl]carbamate
CID 118403115
3-(3-fluoro-4-methoxyphenyl)-2-methyl-N-[2-(3-methylsulfonylphenyl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 177379803
propyl 7-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]-2-[(2-chlorophenyl)methylsulfanyl]-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
CID 135663820
methyl 6-[2-(4-formyl-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 159798650
2-(3,4-dichlorophenyl)ethanol;2-(3,4-dimethoxyphenyl)ethanol;3-(3,4-dimethoxyphenyl)propan-1-ol;2-(2-methylphenyl)ethanol;2-(3-methylphenyl)ethanol;2-(4-methylphenyl)ethanol
CID 157148610

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CCc1ccccc1CCc1ccc2nccn2c1C(=O)O.COc1c(C)cccc1CCc1ccc2nccn2c1C(=O)O.COc1ccc(F)c(CCc2ccc3nccn3c2C(=O)O)c1F.CS(=O)(=O)c1cccc(CCc2ccc3nccn3c2C(=O)O)c1.Cc1ccc(CCc2ccc3nccn3c2C(=O)O)cc1.O=C(O)c1c(CCc2ccccc2Cl)ccc2nccn12.
What is the InChIKey of 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?
The InChIKey is LYVLKAXXQGIQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3.C18H18N2O2.C17H14F2N2O3.C17H16N2O4S.C17H16N2O2.C16H13ClN2O2/c1-12-4-3-5-14(17(12)23-2)7-6-13-8-9-15-19-10-11-20(15)16(13)18(21)22;1-2-13-5-3-4-6-14(13)7-8-15-9-10-16-19-11-12-20(16)17(15)18(21)22;1-24-13-6-5-12(18)11(15(13)19)4-2-10-3-7-14-20-8-9-21(14)16(10)17(22)23;1-24(22,23)14-4-2-3-12(11-14)5-6-13-7-8-15-18-9-10-19(15)16(13)17(20)21;1-12-2-4-13(5-3-12)6-7-14-8-9-15-18-10-11-19(15)16(14)17(20)21;17-13-4-2-1-3-11(13)5-6-12-7-8-14-18-9-10-19(14)15(12)16(20)21/h3-5,8-11H,6-7H2,1-2H3,(H,21,22);3-6,9-12H,2,7-8H2,1H3,(H,21,22);3,5-9H,2,4H2,1H3,(H,22,23);2-4,7-11H,5-6H2,1H3,(H,20,21);2-5,8-11H,6-7H2,1H3,(H,20,21);1-4,7-10H,5-6H2,(H,20,21).
What are the key properties of 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?
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 has a molecular weight of 1862.48 g/mol, XLogP of 18.44, 28 rotatable bonds, 6 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159496399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).