3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate

C65H54Cl3F3N10O8S3 — CID 158317845

IUPAC3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate
SMILESCC(Oc1cc(-c2cnc3cc(C(F)(F)F)ccn23)sc1C(N)=O)c1ccccc1Cl.CCOC(=O)Nc1ccn2c(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.CNC(=O)c1sc(-c2cnc3ccccn23)cc1OC(C)c1ccccc1Cl
InChIInChI=1S/C23H21ClN4O4S.C21H15ClF3N3O2S.C21H18ClN3O2S/c1-3-31-23(30)27-14-8-9-28-17(12-26-20(28)10-14)19-11-18(21(33-19)22(25)29)32-13(2)15-6-4-5-7-16(15)24;1-11(13-4-2-3-5-14(13)22)30-16-9-17(31-19(16)20(26)29)15-10-27-18-8-12(21(23,24)25)6-7-28(15)18;1-13(14-7-3-4-8-15(14)22)27-17-11-18(28-20(17)21(26)23-2)16-12-24-19-9-5-6-10-25(16)19/h4-13H,3H2,1-2H3,(H2,25,29)(H,27,30);2-11H,1H3,(H2,26,29);3-13H,1-2H3,(H,23,26)
InChIKeyGOMGNTBNLZMTHE-UHFFFAOYSA-N
MW1362.76 g/mol
LogP16.71
Rot. Bonds17

About 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate

3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate (PubChem CID 158317845) has the molecular formula C65H54Cl3F3N10O8S3 and a molecular weight of 1362.76 g/mol. Its IUPAC name is 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate.

Molecular Properties

Compound Name3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate
PubChem CID158317845
Molecular FormulaC65H54Cl3F3N10O8S3
Molecular Weight1362.76 g/mol
Exact Mass1360.23
IUPAC Name3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate
SMILESCC(Oc1cc(-c2cnc3cc(C(F)(F)F)ccn23)sc1C(N)=O)c1ccccc1Cl.CCOC(=O)Nc1ccn2c(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.CNC(=O)c1sc(-c2cnc3ccccn23)cc1OC(C)c1ccccc1Cl
InChIInChI=1S/C23H21ClN4O4S.C21H15ClF3N3O2S.C21H18ClN3O2S/c1-3-31-23(30)27-14-8-9-28-17(12-26-20(28)10-14)19-11-18(21(33-19)22(25)29)32-13(2)15-6-4-5-7-16(15)24;1-11(13-4-2-3-5-14(13)22)30-16-9-17(31-19(16)20(26)29)15-10-27-18-8-12(21(23,24)25)6-7-28(15)18;1-13(14-7-3-4-8-15(14)22)27-17-11-18(28-20(17)21(26)23-2)16-12-24-19-9-5-6-10-25(16)19/h4-13H,3H2,1-2H3,(H2,25,29)(H,27,30);2-11H,1H3,(H2,26,29);3-13H,1-2H3,(H,23,26)
InChIKeyGOMGNTBNLZMTHE-UHFFFAOYSA-N
XLogP16.71
TPSA233.20 Ų
H-Bond Donors4
H-Bond Acceptors17
Rotatable Bonds17
Heavy Atoms92
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001362.76
LogP ≤ 516.71
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1017

Analyze 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate with MolForge

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Related Compounds

(R)-3-(1-(2-chloro-4-((4-fluoropiperidin-1-yl)methyl)phenyl)ethoxy)-5-(imidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide
CID 45269431
(R)-3-(1-(2-chloro-4-((3-oxopiperazin-1-yl)methyl)phenyl)ethoxy)-5-(imidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide
CID 45271090
Tert-butyl 3-[4-[3-[5-carbamoyl-4-[1-[2-(trifluoromethyl)phenyl]ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]pyrazol-1-yl]pyrrolidine-1-carboxylate
CID 171351970
Tert-butyl 4-[4-[3-[5-carbamoyl-4-[1-[2-(trifluoromethyl)phenyl]ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]pyrazol-1-yl]piperidine-1-carboxylate
CID 171355954
3-[1-(2-Chlorophenyl)ethoxy]-5-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide
CID 24992960
3-[1-(2-Chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide
CID 24993285
3-[1-(2-Chlorophenyl)ethoxy]-5-[2-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide
CID 67438506
3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-[6-[[2-fluoroethyl(methyl)amino]methyl]imidazo[1,2-a]pyrazin-3-yl]thiophene-2-carboxamide
CID 87400645
3-[1-(2-Chlorophenyl)ethoxy]-5-[6-[[2-fluoroethyl(methyl)amino]methyl]imidazo[1,2-a]pyrazin-3-yl]thiophene-2-carboxamide
CID 87400647
3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-[6-[[2-fluoroethyl(methyl)amino]methyl]imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide
CID 87401000
3-[1-(2-Chlorophenyl)ethoxy]-5-[6-[[2-fluoroethyl(methyl)amino]methyl]imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide
CID 87401002
3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]-N-methylimidazo[1,2-a]pyridine-6-carboxamide;3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]-N-methylimidazo[1,2-a]pyridine-7-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-(6-fluoroimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide
CID 157434800

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate?
The IUPAC name of 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate (CID 158317845) is 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate.
What is the SMILES notation for 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate?
The canonical SMILES for 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate is CC(Oc1cc(-c2cnc3cc(C(F)(F)F)ccn23)sc1C(N)=O)c1ccccc1Cl.CCOC(=O)Nc1ccn2c(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.CNC(=O)c1sc(-c2cnc3ccccn23)cc1OC(C)c1ccccc1Cl.
What is the InChIKey of 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate?
The InChIKey is GOMGNTBNLZMTHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClN4O4S.C21H15ClF3N3O2S.C21H18ClN3O2S/c1-3-31-23(30)27-14-8-9-28-17(12-26-20(28)10-14)19-11-18(21(33-19)22(25)29)32-13(2)15-6-4-5-7-16(15)24;1-11(13-4-2-3-5-14(13)22)30-16-9-17(31-19(16)20(26)29)15-10-27-18-8-12(21(23,24)25)6-7-28(15)18;1-13(14-7-3-4-8-15(14)22)27-17-11-18(28-20(17)21(26)23-2)16-12-24-19-9-5-6-10-25(16)19/h4-13H,3H2,1-2H3,(H2,25,29)(H,27,30);2-11H,1H3,(H2,26,29);3-13H,1-2H3,(H,23,26).
What are the key properties of 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate?
3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate has a molecular weight of 1362.76 g/mol, XLogP of 16.71, 17 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-yl-N-methylthiophene-2-carboxamide;3-[1-(2-chlorophenyl)ethoxy]-5-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate is sourced from PubChem (CID 158317845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).