5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

C136H138ClF4N23O9 — CID 161395438

About 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone (PubChem CID 161395438) has the molecular formula C136H138ClF4N23O9 and a molecular weight of 2350.20 g/mol. Its IUPAC name is 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone.

Molecular Properties

• Compound Name: 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
• PubChem CID: 161395438
• Molecular Formula: C136H138ClF4N23O9
• Molecular Weight: 2350.20 g/mol
• Exact Mass: 2348.07
• IUPAC Name: 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
• SMILES: CC(=O)N1CCc2c(c(Cc3ccc(-c4cc(F)cc(F)c4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Cc3ccc(-c4ccc(CO)cc4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Cc3ccc(-c4ccc(F)c(F)c4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Cc3ccc(-c4cccc(Cl)c4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc(-c4ccc(C(=O)N5CCOCC5)cc4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc(-c4cncc(C#N)c4)cc3)nn2C)C1
• InChI: InChI=1S/C26H29N5O3.C23H25N3O2.C22H22ClN3O.2C22H21F2N3O.C21H20N6O/c1-18(32)31-12-11-24-23(17-31)25(28-29(24)2)27-22-9-7-20(8-10-22)19-3-5-21(6-4-19)26(33)30-13-15-34-16-14-30;1-16(28)26-12-11-23-21(14-26)22(24-25(23)2)13-17-3-7-19(8-4-17)20-9-5-18(15-27)6-10-20;1-15(27)26-11-10-22-20(14-26)21(24-25(22)2)12-16-6-8-17(9-7-16)18-4-3-5-19(23)13-18;1-14(28)27-8-7-22-20(13-27)21(25-26(22)2)9-15-3-5-16(6-4-15)17-10-18(23)12-19(24)11-17;1-14(28)27-10-9-22-18(13-27)21(25-26(22)2)11-15-3-5-16(6-4-15)17-7-8-19(23)20(24)12-17;1-14(28)27-8-7-20-19(13-27)21(25-26(20)2)24-18-5-3-16(4-6-18)17-9-15(10-22)11-23-12-17/h3-10H,11-17H2,1-2H3,(H,27,28);3-10,27H,11-15H2,1-2H3;3-9,13H,10-12,14H2,1-2H3;3-6,10-12H,7-9,13H2,1-2H3;3-8,12H,9-11,13H2,1-2H3;3-6,9,11-12H,7-8,13H2,1-2H3,(H,24,25)
• InChIKey: VTNOKFKSDMZRQS-UHFFFAOYSA-N
• XLogP: 21.24
• TPSA: 339.29 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 25
• Rotatable Bonds: 20
• Heavy Atoms: 173
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2350.20
LogP ≤ 5	21.24
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

The IUPAC name of 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone (CID 161395438) is 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone.

What is the SMILES notation for 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

The canonical SMILES for 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone is CC(=O)N1CCc2c(c(Cc3ccc(-c4cc(F)cc(F)c4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Cc3ccc(-c4ccc(CO)cc4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Cc3ccc(-c4ccc(F)c(F)c4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Cc3ccc(-c4cccc(Cl)c4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc(-c4ccc(C(=O)N5CCOCC5)cc4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc(-c4cncc(C#N)c4)cc3)nn2C)C1.

What is the InChIKey of 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

The InChIKey is VTNOKFKSDMZRQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N5O3.C23H25N3O2.C22H22ClN3O.2C22H21F2N3O.C21H20N6O/c1-18(32)31-12-11-24-23(17-31)25(28-29(24)2)27-22-9-7-20(8-10-22)19-3-5-21(6-4-19)26(33)30-13-15-34-16-14-30;1-16(28)26-12-11-23-21(14-26)22(24-25(23)2)13-17-3-7-19(8-4-17)20-9-5-18(15-27)6-10-20;1-15(27)26-11-10-22-20(14-26)21(24-25(22)2)12-16-6-8-17(9-7-16)18-4-3-5-19(23)13-18;1-14(28)27-8-7-22-20(13-27)21(25-26(22)2)9-15-3-5-16(6-4-15)17-10-18(23)12-19(24)11-17;1-14(28)27-10-9-22-18(13-27)21(25-26(22)2)11-15-3-5-16(6-4-15)17-7-8-19(23)20(24)12-17;1-14(28)27-8-7-20-19(13-27)21(25-26(20)2)24-18-5-3-16(4-6-18)17-9-15(10-22)11-23-12-17/h3-10H,11-17H2,1-2H3,(H,27,28);3-10,27H,11-15H2,1-2H3;3-9,13H,10-12,14H2,1-2H3;3-6,10-12H,7-9,13H2,1-2H3;3-8,12H,9-11,13H2,1-2H3;3-6,9,11-12H,7-8,13H2,1-2H3,(H,24,25).

What are the key properties of 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone has a molecular weight of 2350.20 g/mol, XLogP of 21.24, 20 rotatable bonds, 3 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[3-[[4-(3-chlorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,4-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone is sourced from PubChem (CID 161395438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).