N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide

C112H115Cl3F6N20O5S2 — CID 157221792

About N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide

N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide (PubChem CID 157221792) has the molecular formula C112H115Cl3F6N20O5S2 and a molecular weight of 2105.77 g/mol. Its IUPAC name is N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide.

Molecular Properties

• Compound Name: N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide
• PubChem CID: 157221792
• Molecular Formula: C112H115Cl3F6N20O5S2
• Molecular Weight: 2105.77 g/mol
• Exact Mass: 2102.78
• IUPAC Name: N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide
• SMILES: CCCCN(Cc1nc2cccnc2n1CCC)C(=O)c1cc(Cl)ccc1Cl.CCCN(Cc1nc2cccnc2n1CCC)C(=O)c1ccc(C)s1.CCCn1c(CN(Cc2ccc(F)cc2)C(=O)c2c(F)cccc2Cl)nc2cccnc21.CCCn1c(CN(Cc2ccccc2)C(=O)c2c(F)cccc2C(F)(F)F)nc2cccnc21.CCCn1c(CN(Cc2ccccc2)C(=O)c2sccc2C)nc2cccnc21
• InChI: InChI=1S/C25H22F4N4O.C24H21ClF2N4O.C23H24N4OS.C21H24Cl2N4O.C19H24N4OS/c1-2-14-33-21(31-20-12-7-13-30-23(20)33)16-32(15-17-8-4-3-5-9-17)24(34)22-18(25(27,28)29)10-6-11-19(22)26;1-2-13-31-21(29-20-7-4-12-28-23(20)31)15-30(14-16-8-10-17(26)11-9-16)24(32)22-18(25)5-3-6-19(22)27;1-3-13-27-20(25-19-10-7-12-24-22(19)27)16-26(15-18-8-5-4-6-9-18)23(28)21-17(2)11-14-29-21;1-3-5-12-26(21(28)16-13-15(22)8-9-17(16)23)14-19-25-18-7-6-10-24-20(18)27(19)11-4-2;1-4-11-22(19(24)16-9-8-14(3)25-16)13-17-21-15-7-6-10-20-18(15)23(17)12-5-2/h3-13H,2,14-16H2,1H3;3-12H,2,13-15H2,1H3;4-12,14H,3,13,15-16H2,1-2H3;6-10,13H,3-5,11-12,14H2,1-2H3;6-10H,4-5,11-13H2,1-3H3
• InChIKey: ATBURIOLORZVDD-UHFFFAOYSA-N
• XLogP: 26.37
• TPSA: 255.10 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 36
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2105.77
LogP ≤ 5	26.37
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide?

The IUPAC name of N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide (CID 157221792) is N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide.

What is the SMILES notation for N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide?

The canonical SMILES for N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide is CCCCN(Cc1nc2cccnc2n1CCC)C(=O)c1cc(Cl)ccc1Cl.CCCN(Cc1nc2cccnc2n1CCC)C(=O)c1ccc(C)s1.CCCn1c(CN(Cc2ccc(F)cc2)C(=O)c2c(F)cccc2Cl)nc2cccnc21.CCCn1c(CN(Cc2ccccc2)C(=O)c2c(F)cccc2C(F)(F)F)nc2cccnc21.CCCn1c(CN(Cc2ccccc2)C(=O)c2sccc2C)nc2cccnc21.

What is the InChIKey of N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide?

The InChIKey is ATBURIOLORZVDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22F4N4O.C24H21ClF2N4O.C23H24N4OS.C21H24Cl2N4O.C19H24N4OS/c1-2-14-33-21(31-20-12-7-13-30-23(20)33)16-32(15-17-8-4-3-5-9-17)24(34)22-18(25(27,28)29)10-6-11-19(22)26;1-2-13-31-21(29-20-7-4-12-28-23(20)31)15-30(14-16-8-10-17(26)11-9-16)24(32)22-18(25)5-3-6-19(22)27;1-3-13-27-20(25-19-10-7-12-24-22(19)27)16-26(15-18-8-5-4-6-9-18)23(28)21-17(2)11-14-29-21;1-3-5-12-26(21(28)16-13-15(22)8-9-17(16)23)14-19-25-18-7-6-10-24-20(18)27(19)11-4-2;1-4-11-22(19(24)16-9-8-14(3)25-16)13-17-21-15-7-6-10-20-18(15)23(17)12-5-2/h3-13H,2,14-16H2,1H3;3-12H,2,13-15H2,1H3;4-12,14H,3,13,15-16H2,1-2H3;6-10,13H,3-5,11-12,14H2,1-2H3;6-10H,4-5,11-13H2,1-3H3.

What are the key properties of N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide?

N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide has a molecular weight of 2105.77 g/mol, XLogP of 26.37, 36 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-benzyl-2-fluoro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-6-(trifluoromethyl)benzamide;N-benzyl-3-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;N-butyl-2,5-dichloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-6-fluoro-N-[(4-fluorophenyl)methyl]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;5-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide is sourced from PubChem (CID 157221792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).