N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide

C88H90Cl4N28O8 — CID 159262799

About N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide

N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide (PubChem CID 159262799) has the molecular formula C88H90Cl4N28O8 and a molecular weight of 1809.69 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide.

Molecular Properties

• Compound Name: N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide
• PubChem CID: 159262799
• Molecular Formula: C88H90Cl4N28O8
• Molecular Weight: 1809.69 g/mol
• Exact Mass: 1806.63
• IUPAC Name: N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide
• SMILES: CN1CCN=C1c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCCCC1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCOCC1.[H]/N=C(/c1ccc(CNc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCCC1
• InChI: InChI=1S/C23H24ClN7O2.C22H22ClN7O3.C22H24ClN7O.C21H20ClN7O2/c1-30-21(18(14-27-30)23(33)28-19-10-9-17(24)13-26-19)29-22(32)16-7-5-15(6-8-16)20(25)31-11-3-2-4-12-31;1-29-20(17(13-26-29)22(32)27-18-7-6-16(23)12-25-18)28-21(31)15-4-2-14(3-5-15)19(24)30-8-10-33-11-9-30;1-29-21(18(14-27-29)22(31)28-19-9-8-17(23)13-25-19)26-12-15-4-6-16(7-5-15)20(24)30-10-2-3-11-30;1-28-10-9-23-18(28)13-3-5-14(6-4-13)20(30)27-19-16(12-25-29(19)2)21(31)26-17-8-7-15(22)11-24-17/h5-10,13-14,25H,2-4,11-12H2,1H3,(H,29,32)(H,26,28,33);2-7,12-13,24H,8-11H2,1H3,(H,28,31)(H,25,27,32);4-9,13-14,24,26H,2-3,10-12H2,1H3,(H,25,28,31);3-8,11-12H,9-10H2,1-2H3,(H,27,30)(H,24,26,31)/b25-20-;24-19-;24-20-
• InChIKey: KWSKHYRDEVKXNY-GFBJYXADSA-N
• XLogP: 12.83
• TPSA: 444.67 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 26
• Rotatable Bonds: 21
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1809.69
LogP ≤ 5	12.83
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide?

The IUPAC name of N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide (CID 159262799) is N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide.

What is the SMILES notation for N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide?

The canonical SMILES for N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide is CN1CCN=C1c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCCCC1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCOCC1.[H]/N=C(/c1ccc(CNc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCCC1.

What is the InChIKey of N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide?

The InChIKey is KWSKHYRDEVKXNY-GFBJYXADSA-N. The full InChI is InChI=1S/C23H24ClN7O2.C22H22ClN7O3.C22H24ClN7O.C21H20ClN7O2/c1-30-21(18(14-27-30)23(33)28-19-10-9-17(24)13-26-19)29-22(32)16-7-5-15(6-8-16)20(25)31-11-3-2-4-12-31;1-29-20(17(13-26-29)22(32)27-18-7-6-16(23)12-25-18)28-21(31)15-4-2-14(3-5-15)19(24)30-8-10-33-11-9-30;1-29-21(18(14-27-29)22(31)28-19-9-8-17(23)13-25-19)26-12-15-4-6-16(7-5-15)20(24)30-10-2-3-11-30;1-28-10-9-23-18(28)13-3-5-14(6-4-13)20(30)27-19-16(12-25-29(19)2)21(31)26-17-8-7-15(22)11-24-17/h5-10,13-14,25H,2-4,11-12H2,1H3,(H,29,32)(H,26,28,33);2-7,12-13,24H,8-11H2,1H3,(H,28,31)(H,25,27,32);4-9,13-14,24,26H,2-3,10-12H2,1H3,(H,25,28,31);3-8,11-12H,9-10H2,1-2H3,(H,27,30)(H,24,26,31)/b25-20-;24-19-;24-20-;.

What are the key properties of N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide?

N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide has a molecular weight of 1809.69 g/mol, XLogP of 12.83, 21 rotatable bonds, 11 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)phenyl]methylamino]pyrazole-4-carboxamide is sourced from PubChem (CID 159262799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).