N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide

C88H76Cl4N18O7 — CID 158054518

About N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide

N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide (PubChem CID 158054518) has the molecular formula C88H76Cl4N18O7 and a molecular weight of 1639.51 g/mol. Its IUPAC name is N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide
• PubChem CID: 158054518
• Molecular Formula: C88H76Cl4N18O7
• Molecular Weight: 1639.51 g/mol
• Exact Mass: 1636.49
• IUPAC Name: N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide
• SMILES: CN1CCN(c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cc2)C(=O)C1.Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cn2)n1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(N2CCNCC2=O)cc1.O=C1CN(c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cn2)CCN1
• InChI: InChI=1S/C23H21ClN4O2.C22H18ClN5O.C22H19ClN4O2.C21H18ClN5O2/c1-27-12-13-28(22(29)15-27)18-8-5-16(6-9-18)23(30)26-17-7-10-20(24)19(14-17)21-4-2-3-11-25-21;1-14-11-15(2)28(27-14)21-9-6-16(13-25-21)22(29)26-17-7-8-19(23)18(12-17)20-5-3-4-10-24-20;23-19-9-6-16(13-18(19)20-3-1-2-10-25-20)26-22(29)15-4-7-17(8-5-15)27-12-11-24-14-21(27)28;22-17-6-5-15(11-16(17)18-3-1-2-8-23-18)26-21(29)14-4-7-19(25-12-14)27-10-9-24-20(28)13-27/h2-11,14H,12-13,15H2,1H3,(H,26,30);3-13H,1-2H3,(H,26,29);1-10,13,24H,11-12,14H2,(H,26,29);1-8,11-12H,9-10,13H2,(H,24,28)(H,26,29)
• InChIKey: FJWMDLXURDUIHZ-UHFFFAOYSA-N
• XLogP: 15.36
• TPSA: 299.79 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 18
• Rotatable Bonds: 16
• Heavy Atoms: 117
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1639.51
LogP ≤ 5	15.36
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide?

The IUPAC name of N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide (CID 158054518) is N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide.

What is the SMILES notation for N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide?

The canonical SMILES for N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide is CN1CCN(c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cc2)C(=O)C1.Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cn2)n1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(N2CCNCC2=O)cc1.O=C1CN(c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cn2)CCN1.

What is the InChIKey of N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide?

The InChIKey is FJWMDLXURDUIHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClN4O2.C22H18ClN5O.C22H19ClN4O2.C21H18ClN5O2/c1-27-12-13-28(22(29)15-27)18-8-5-16(6-9-18)23(30)26-17-7-10-20(24)19(14-17)21-4-2-3-11-25-21;1-14-11-15(2)28(27-14)21-9-6-16(13-25-21)22(29)26-17-7-8-19(23)18(12-17)20-5-3-4-10-24-20;23-19-9-6-16(13-18(19)20-3-1-2-10-25-20)26-22(29)15-4-7-17(8-5-15)27-12-11-24-14-21(27)28;22-17-6-5-15(11-16(17)18-3-1-2-8-23-18)26-21(29)14-4-7-19(25-12-14)27-10-9-24-20(28)13-27/h2-11,14H,12-13,15H2,1H3,(H,26,30);3-13H,1-2H3,(H,26,29);1-10,13,24H,11-12,14H2,(H,26,29);1-8,11-12H,9-10,13H2,(H,24,28)(H,26,29).

What are the key properties of N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide?

N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide has a molecular weight of 1639.51 g/mol, XLogP of 15.36, 16 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-methyl-2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-oxopiperazin-1-yl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 158054518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).