3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

C91H107N31O7 — CID 158370127

About 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone (PubChem CID 158370127) has the molecular formula C91H107N31O7 and a molecular weight of 1747.07 g/mol. Its IUPAC name is 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone.

Molecular Properties

• Compound Name: 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
• PubChem CID: 158370127
• Molecular Formula: C91H107N31O7
• Molecular Weight: 1747.07 g/mol
• Exact Mass: 1745.90
• IUPAC Name: 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
• SMILES: CC(=O)N1CCc2c(c(Nc3cc(C(=O)NC(C)C)cc(-c4cnn(C)c4)c3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc(-c4cnco4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc4c(cnn4C)c3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc4cnn(C)c4c3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc4nn(C)nc4c3)nn2C)C1
• InChI: InChI=1S/C23H29N7O2.C18H19N5O2.2C17H20N6O.C16H19N7O/c1-14(2)25-23(32)17-8-16(18-11-24-28(4)12-18)9-19(10-17)26-22-20-13-30(15(3)31)7-6-21(20)29(5)27-22;1-12(24)23-8-7-16-15(10-23)18(21-22(16)2)20-14-5-3-13(4-6-14)17-9-19-11-25-17;1-11(24)23-7-6-16-14(10-23)17(20-22(16)3)19-13-4-5-15-12(8-13)9-18-21(15)2;1-11(24)23-7-6-15-14(10-23)17(20-22(15)3)19-13-5-4-12-9-18-21(2)16(12)8-13;1-10(24)23-7-6-15-12(9-23)16(20-21(15)2)17-11-4-5-13-14(8-11)19-22(3)18-13/h8-12,14H,6-7,13H2,1-5H3,(H,25,32)(H,26,27);3-6,9,11H,7-8,10H2,1-2H3,(H,20,21);2*4-5,8-9H,6-7,10H2,1-3H3,(H,19,20);4-5,8H,6-7,9H2,1-3H3,(H,17,20)
• InChIKey: GUMXRTGHPARDQC-UHFFFAOYSA-N
• XLogP: 10.59
• TPSA: 390.10 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 32
• Rotatable Bonds: 14
• Heavy Atoms: 129
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1747.07
LogP ≤ 5	10.59
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

The IUPAC name of 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone (CID 158370127) is 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone.

What is the SMILES notation for 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

The canonical SMILES for 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone is CC(=O)N1CCc2c(c(Nc3cc(C(=O)NC(C)C)cc(-c4cnn(C)c4)c3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc(-c4cnco4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc4c(cnn4C)c3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc4cnn(C)c4c3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc4nn(C)nc4c3)nn2C)C1.

What is the InChIKey of 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

The InChIKey is GUMXRTGHPARDQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N7O2.C18H19N5O2.2C17H20N6O.C16H19N7O/c1-14(2)25-23(32)17-8-16(18-11-24-28(4)12-18)9-19(10-17)26-22-20-13-30(15(3)31)7-6-21(20)29(5)27-22;1-12(24)23-8-7-16-15(10-23)18(21-22(16)2)20-14-5-3-13(4-6-14)17-9-19-11-25-17;1-11(24)23-7-6-16-14(10-23)17(20-22(16)3)19-13-4-5-15-12(8-13)9-18-21(15)2;1-11(24)23-7-6-15-14(10-23)17(20-22(15)3)19-13-5-4-12-9-18-21(2)16(12)8-13;1-10(24)23-7-6-15-12(9-23)16(20-21(15)2)17-11-4-5-13-14(8-11)19-22(3)18-13/h8-12,14H,6-7,13H2,1-5H3,(H,25,32)(H,26,27);3-6,9,11H,7-8,10H2,1-2H3,(H,20,21);2*4-5,8-9H,6-7,10H2,1-3H3,(H,19,20);4-5,8H,6-7,9H2,1-3H3,(H,17,20).

What are the key properties of 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone has a molecular weight of 1747.07 g/mol, XLogP of 10.59, 14 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylbenzamide;1-[1-methyl-3-[(2-methylbenzotriazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-5-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[(1-methylindazol-6-yl)amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone is sourced from PubChem (CID 158370127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).