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

C85H68Cl4F4N14O10S4 — CID 157434800

IUPAC3-[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
SMILESCC(Oc1cc(-c2cnc3ccc(C(F)(F)F)cn23)sc1C(N)=O)c1ccccc1Cl.CC(Oc1cc(-c2cnc3ccc(F)cn23)sc1C(N)=O)c1ccccc1Cl.CNC(=O)c1ccc2ncc(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)n2c1.CNC(=O)c1ccn2c(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1
InChIInChI=1S/2C22H19ClN4O3S.C21H15ClF3N3O2S.C20H15ClFN3O2S/c1-12(14-5-3-4-6-15(14)23)30-17-9-18(31-20(17)21(24)28)16-10-26-19-8-7-13(11-27(16)19)22(29)25-2;1-12(14-5-3-4-6-15(14)23)30-17-10-18(31-20(17)21(24)28)16-11-26-19-9-13(22(29)25-2)7-8-27(16)19;1-11(13-4-2-3-5-14(13)22)30-16-8-17(31-19(16)20(26)29)15-9-27-18-7-6-12(10-28(15)18)21(23,24)25;1-11(13-4-2-3-5-14(13)21)27-16-8-17(28-19(16)20(23)26)15-9-24-18-7-6-12(22)10-25(15)18/h2*3-12H,1-2H3,(H2,24,28)(H,25,29);2-11H,1H3,(H2,26,29);2-11H,1H3,(H2,23,26)
InChIKeyBQYYSGKXBMHBJD-UHFFFAOYSA-N
MW1791.64 g/mol
LogP19.70
Rot. Bonds22

About 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

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 (PubChem CID 157434800) has the molecular formula C85H68Cl4F4N14O10S4 and a molecular weight of 1791.64 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name3-[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
PubChem CID157434800
Molecular FormulaC85H68Cl4F4N14O10S4
Molecular Weight1791.64 g/mol
Exact Mass1788.28
IUPAC Name3-[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
SMILESCC(Oc1cc(-c2cnc3ccc(C(F)(F)F)cn23)sc1C(N)=O)c1ccccc1Cl.CC(Oc1cc(-c2cnc3ccc(F)cn23)sc1C(N)=O)c1ccccc1Cl.CNC(=O)c1ccc2ncc(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)n2c1.CNC(=O)c1ccn2c(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1
InChIInChI=1S/2C22H19ClN4O3S.C21H15ClF3N3O2S.C20H15ClFN3O2S/c1-12(14-5-3-4-6-15(14)23)30-17-9-18(31-20(17)21(24)28)16-10-26-19-8-7-13(11-27(16)19)22(29)25-2;1-12(14-5-3-4-6-15(14)23)30-17-10-18(31-20(17)21(24)28)16-11-26-19-9-13(22(29)25-2)7-8-27(16)19;1-11(13-4-2-3-5-14(13)22)30-16-8-17(31-19(16)20(26)29)15-9-27-18-7-6-12(10-28(15)18)21(23,24)25;1-11(13-4-2-3-5-14(13)21)27-16-8-17(28-19(16)20(23)26)15-9-24-18-7-6-12(22)10-25(15)18/h2*3-12H,1-2H3,(H2,24,28)(H,25,29);2-11H,1H3,(H2,26,29);2-11H,1H3,(H2,23,26)
InChIKeyBQYYSGKXBMHBJD-UHFFFAOYSA-N
XLogP19.70
TPSA336.68 Ų
H-Bond Donors6
H-Bond Acceptors22
Rotatable Bonds22
Heavy Atoms121
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001791.64
LogP ≤ 519.70
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1022

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC(Oc1cc(-c2cnc3ccc(C(F)(F)F)cn23)sc1C(N)=O)c1ccccc1Cl.CC(Oc1cc(-c2cnc3ccc(F)cn23)sc1C(N)=O)c1ccccc1Cl.CNC(=O)c1ccc2ncc(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)n2c1.CNC(=O)c1ccn2c(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.
What is the InChIKey of 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?
The InChIKey is BQYYSGKXBMHBJD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H19ClN4O3S.C21H15ClF3N3O2S.C20H15ClFN3O2S/c1-12(14-5-3-4-6-15(14)23)30-17-9-18(31-20(17)21(24)28)16-10-26-19-8-7-13(11-27(16)19)22(29)25-2;1-12(14-5-3-4-6-15(14)23)30-17-10-18(31-20(17)21(24)28)16-11-26-19-9-13(22(29)25-2)7-8-27(16)19;1-11(13-4-2-3-5-14(13)22)30-16-8-17(31-19(16)20(26)29)15-9-27-18-7-6-12(10-28(15)18)21(23,24)25;1-11(13-4-2-3-5-14(13)21)27-16-8-17(28-19(16)20(23)26)15-9-24-18-7-6-12(22)10-25(15)18/h2*3-12H,1-2H3,(H2,24,28)(H,25,29);2-11H,1H3,(H2,26,29);2-11H,1H3,(H2,23,26).
What are the key properties of 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?
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 has a molecular weight of 1791.64 g/mol, XLogP of 19.70, 22 rotatable bonds, 6 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 157434800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).