2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide

C95H76Cl4N18O9 — CID 159155926

About 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide

2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide (PubChem CID 159155926) has the molecular formula C95H76Cl4N18O9 and a molecular weight of 1755.58 g/mol. Its IUPAC name is 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide.

Molecular Properties

• Compound Name: 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide
• PubChem CID: 159155926
• Molecular Formula: C95H76Cl4N18O9
• Molecular Weight: 1755.58 g/mol
• Exact Mass: 1752.48
• IUPAC Name: 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide
• SMILES: CC(C)(C)NC(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cn1.COc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cn2)cn1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(C(=O)NCc2ccccc2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(C(=O)NCc2ccccn2)nc1
• InChI: InChI=1S/C25H19ClN4O2.C24H18ClN5O3.C24H18ClN5O2.C22H21ClN4O2/c26-21-11-10-19(14-20(21)22-8-4-5-13-27-22)30-24(31)18-9-12-23(28-16-18)25(32)29-15-17-6-2-1-3-7-17;1-33-22-10-7-17(14-28-22)30-24(32)21-9-5-15(13-27-21)23(31)29-16-6-8-19(25)18(12-16)20-4-2-3-11-26-20;25-20-9-8-17(13-19(20)21-6-2-4-12-27-21)30-23(31)16-7-10-22(28-14-16)24(32)29-15-18-5-1-3-11-26-18;1-22(2,3)27-21(29)19-10-7-14(13-25-19)20(28)26-15-8-9-17(23)16(12-15)18-6-4-5-11-24-18/h1-14,16H,15H2,(H,29,32)(H,30,31);2-14H,1H3,(H,29,31)(H,30,32);1-14H,15H2,(H,29,32)(H,30,31);4-13H,1-3H3,(H,26,28)(H,27,29)
• InChIKey: KJWUYLQCEYXNOK-UHFFFAOYSA-N
• XLogP: 18.64
• TPSA: 370.93 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 19
• Rotatable Bonds: 22
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1755.58
LogP ≤ 5	18.64
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide?

The IUPAC name of 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide (CID 159155926) is 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide.

What is the SMILES notation for 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide?

The canonical SMILES for 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide is CC(C)(C)NC(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cn1.COc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cn2)cn1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(C(=O)NCc2ccccc2)nc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(C(=O)NCc2ccccn2)nc1.

What is the InChIKey of 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide?

The InChIKey is KJWUYLQCEYXNOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19ClN4O2.C24H18ClN5O3.C24H18ClN5O2.C22H21ClN4O2/c26-21-11-10-19(14-20(21)22-8-4-5-13-27-22)30-24(31)18-9-12-23(28-16-18)25(32)29-15-17-6-2-1-3-7-17;1-33-22-10-7-17(14-28-22)30-24(32)21-9-5-15(13-27-21)23(31)29-16-6-8-19(25)18(12-16)20-4-2-3-11-26-20;25-20-9-8-17(13-19(20)21-6-2-4-12-27-21)30-23(31)16-7-10-22(28-14-16)24(32)29-15-18-5-1-3-11-26-18;1-22(2,3)27-21(29)19-10-7-14(13-25-19)20(28)26-15-8-9-17(23)16(12-15)18-6-4-5-11-24-18/h1-14,16H,15H2,(H,29,32)(H,30,31);2-14H,1H3,(H,29,31)(H,30,32);1-14H,15H2,(H,29,32)(H,30,31);4-13H,1-3H3,(H,26,28)(H,27,29).

What are the key properties of 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide?

2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide has a molecular weight of 1755.58 g/mol, XLogP of 18.64, 22 rotatable bonds, 8 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 2-N-benzyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;2-N-tert-butyl-5-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide;5-N-(4-chloro-3-pyridin-2-ylphenyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,5-dicarboxamide is sourced from PubChem (CID 159155926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).