cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol

C96H122N32O5 — CID 159915524

About cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol

cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol (PubChem CID 159915524) has the molecular formula C96H122N32O5 and a molecular weight of 1804.25 g/mol. Its IUPAC name is cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol.

Molecular Properties

• Compound Name: cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol
• PubChem CID: 159915524
• Molecular Formula: C96H122N32O5
• Molecular Weight: 1804.25 g/mol
• Exact Mass: 1803.03
• IUPAC Name: cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol
• SMILES: CCC(CC)n1cc(-c2nc(-c3cnn(C4CN(C(=O)C(C)C)C4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(C4CN(C(=O)C5CC5)C4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(C[C@@H](O)CN4CC(OC)C4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(C[C@H](O)CN4CCCC4)c3)cn3nccc23)cn1
• InChI: InChI=1S/C24H32N8O2.C24H28N8O.C24H30N8O.C24H32N8O/c1-4-19(5-2)31-11-18(9-27-31)24-23-6-7-25-32(23)16-22(28-24)17-8-26-30(10-17)13-20(33)12-29-14-21(15-29)34-3;1-3-19(4-2)30-12-18(10-27-30)23-22-7-8-25-32(22)15-21(28-23)17-9-26-31(11-17)20-13-29(14-20)24(33)16-5-6-16;1-5-19(6-2)30-12-18(10-27-30)23-22-7-8-25-32(22)15-21(28-23)17-9-26-31(11-17)20-13-29(14-20)24(33)16(3)4;1-3-20(4-2)31-14-19(12-27-31)24-23-7-8-25-32(23)17-22(28-24)18-11-26-30(13-18)16-21(33)15-29-9-5-6-10-29/h6-11,16,19-21,33H,4-5,12-15H2,1-3H3;7-12,15-16,19-20H,3-6,13-14H2,1-2H3;7-12,15-16,19-20H,5-6,13-14H2,1-4H3;7-8,11-14,17,20-21,33H,3-6,9-10,15-16H2,1-2H3/t20-;;;21-/m0..1/s1
• InChIKey: NXSQCRGORIQMIE-KNWSWQGLSA-N
• XLogP: 13.25
• TPSA: 360.11 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 35
• Rotatable Bonds: 33
• Heavy Atoms: 133
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1804.25
LogP ≤ 5	13.25
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	35

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol?

The IUPAC name of cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol (CID 159915524) is cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol.

What is the SMILES notation for cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol?

The canonical SMILES for cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol is CCC(CC)n1cc(-c2nc(-c3cnn(C4CN(C(=O)C(C)C)C4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(C4CN(C(=O)C5CC5)C4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(C[C@@H](O)CN4CC(OC)C4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(C[C@H](O)CN4CCCC4)c3)cn3nccc23)cn1.

What is the InChIKey of cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol?

The InChIKey is NXSQCRGORIQMIE-KNWSWQGLSA-N. The full InChI is InChI=1S/C24H32N8O2.C24H28N8O.C24H30N8O.C24H32N8O/c1-4-19(5-2)31-11-18(9-27-31)24-23-6-7-25-32(23)16-22(28-24)17-8-26-30(10-17)13-20(33)12-29-14-21(15-29)34-3;1-3-19(4-2)30-12-18(10-27-30)23-22-7-8-25-32(22)15-21(28-23)17-9-26-31(11-17)20-13-29(14-20)24(33)16-5-6-16;1-5-19(6-2)30-12-18(10-27-30)23-22-7-8-25-32(22)15-21(28-23)17-9-26-31(11-17)20-13-29(14-20)24(33)16(3)4;1-3-20(4-2)31-14-19(12-27-31)24-23-7-8-25-32(23)17-22(28-24)18-11-26-30(13-18)16-21(33)15-29-9-5-6-10-29/h6-11,16,19-21,33H,4-5,12-15H2,1-3H3;7-12,15-16,19-20H,3-6,13-14H2,1-2H3;7-12,15-16,19-20H,5-6,13-14H2,1-4H3;7-8,11-14,17,20-21,33H,3-6,9-10,15-16H2,1-2H3/t20-;;;21-/m0..1/s1.

What are the key properties of cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol?

cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol has a molecular weight of 1804.25 g/mol, XLogP of 13.25, 33 rotatable bonds, 2 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for cyclopropyl-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]methanone;(2S)-1-(3-methoxyazetidin-1-yl)-3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]propan-2-ol;2-methyl-1-[3-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]azetidin-1-yl]propan-1-one;(2R)-1-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]-3-pyrrolidin-1-ylpropan-2-ol is sourced from PubChem (CID 159915524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).