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

C92H92Cl4N24O9 — CID 159354347

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

N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(morpholine-4-carboximidoyl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide (PubChem CID 159354347) has the molecular formula C92H92Cl4N24O9 and a molecular weight of 1819.72 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(morpholine-4-carboximidoyl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide.

Molecular Properties

• Compound Name: N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(morpholine-4-carboximidoyl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide
• PubChem CID: 159354347
• Molecular Formula: C92H92Cl4N24O9
• Molecular Weight: 1819.72 g/mol
• Exact Mass: 1816.62
• IUPAC Name: N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(morpholine-4-carboximidoyl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide
• SMILES: CN1CCN=C1c1ccc(C(=O)Cc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1.[H]/N=C(/c1ccc(C(=O)Cc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCCC1.[H]/N=C(/c1ccc(C(=O)Cc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCCCC1.[H]/N=C(/c1ccc(C(=O)Cc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCOCC1
• InChI: InChI=1S/C24H25ClN6O2.C23H23ClN6O3.C23H23ClN6O2.C22H21ClN6O2/c1-30-20(19(15-28-30)24(33)29-22-10-9-18(25)14-27-22)13-21(32)16-5-7-17(8-6-16)23(26)31-11-3-2-4-12-31;1-29-19(18(14-27-29)23(32)28-21-7-6-17(24)13-26-21)12-20(31)15-2-4-16(5-3-15)22(25)30-8-10-33-11-9-30;1-29-19(18(14-27-29)23(32)28-21-9-8-17(24)13-26-21)12-20(31)15-4-6-16(7-5-15)22(25)30-10-2-3-11-30;1-28-10-9-24-21(28)15-5-3-14(4-6-15)19(30)11-18-17(13-26-29(18)2)22(31)27-20-8-7-16(23)12-25-20/h5-10,14-15,26H,2-4,11-13H2,1H3,(H,27,29,33);2-7,13-14,25H,8-12H2,1H3,(H,26,28,32);4-9,13-14,25H,2-3,10-12H2,1H3,(H,26,28,32);3-8,12-13H,9-11H2,1-2H3,(H,25,27,31)/b26-23-;2*25-22-
• InChIKey: LHSVDDRBLIKNFP-LLTOSATOSA-N
• XLogP: 13.17
• TPSA: 413.62 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 26
• Rotatable Bonds: 24
• Heavy Atoms: 129
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1819.72
LogP ≤ 5	13.17
H-Bond Donors ≤ 5	7
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-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(morpholine-4-carboximidoyl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide?

The IUPAC name of N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(morpholine-4-carboximidoyl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide (CID 159354347) is N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(morpholine-4-carboximidoyl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide.

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

The canonical SMILES for N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(morpholine-4-carboximidoyl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide is CN1CCN=C1c1ccc(C(=O)Cc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1.[H]/N=C(/c1ccc(C(=O)Cc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCCC1.[H]/N=C(/c1ccc(C(=O)Cc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCCCC1.[H]/N=C(/c1ccc(C(=O)Cc2c(C(=O)Nc3ccc(Cl)cn3)cnn2C)cc1)N1CCOCC1.

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

The InChIKey is LHSVDDRBLIKNFP-LLTOSATOSA-N. The full InChI is InChI=1S/C24H25ClN6O2.C23H23ClN6O3.C23H23ClN6O2.C22H21ClN6O2/c1-30-20(19(15-28-30)24(33)29-22-10-9-18(25)14-27-22)13-21(32)16-5-7-17(8-6-16)23(26)31-11-3-2-4-12-31;1-29-19(18(14-27-29)23(32)28-21-7-6-17(24)13-26-21)12-20(31)15-2-4-16(5-3-15)22(25)30-8-10-33-11-9-30;1-29-19(18(14-27-29)23(32)28-21-9-8-17(24)13-26-21)12-20(31)15-4-6-16(7-5-15)22(25)30-10-2-3-11-30;1-28-10-9-24-21(28)15-5-3-14(4-6-15)19(30)11-18-17(13-26-29(18)2)22(31)27-20-8-7-16(23)12-25-20/h5-10,14-15,26H,2-4,11-13H2,1H3,(H,27,29,33);2-7,13-14,25H,8-12H2,1H3,(H,26,28,32);4-9,13-14,25H,2-3,10-12H2,1H3,(H,26,28,32);3-8,12-13H,9-11H2,1-2H3,(H,25,27,31)/b26-23-;2*25-22-;.

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

N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(morpholine-4-carboximidoyl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide has a molecular weight of 1819.72 g/mol, XLogP of 13.17, 24 rotatable bonds, 7 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-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-[4-(morpholine-4-carboximidoyl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide is sourced from PubChem (CID 159354347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).