(3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone)

C171H168ClF2N25O18 — CID 160864582

About (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone)

(3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone) (PubChem CID 160864582) has the molecular formula C171H168ClF2N25O18 and a molecular weight of 2934.83 g/mol. Its IUPAC name is (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone).

Molecular Properties

• Compound Name: (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone)
• PubChem CID: 160864582
• Molecular Formula: C171H168ClF2N25O18
• Molecular Weight: 2934.83 g/mol
• Exact Mass: 2932.27
• IUPAC Name: (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone)
• SMILES: COCc1ccccc1C(=O)N1CCn2nc(OCc3ccccc3)cc2C1.COc1ccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)cc1F.Cc1cc(C#N)cc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1.Cc1cc(Cl)cc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1.Cc1ccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c(F)c1.Cc1ccc(C(=O)N2Cc3cc(OCc4ccccc4)nn3C[C@H]2C)cc1.Cc1cccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1.Cc1cccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1
• InChI: InChI=1S/C22H20N4O2.C22H23N3O3.C22H23N3O2.C21H20ClN3O2.C21H20FN3O3.C21H20FN3O2.2C21H21N3O2/c1-16-9-18(13-23)11-19(10-16)22(27)25-7-8-26-20(14-25)12-21(24-26)28-15-17-5-3-2-4-6-17;1-27-16-18-9-5-6-10-20(18)22(26)24-11-12-25-19(14-24)13-21(23-25)28-15-17-7-3-2-4-8-17;1-16-8-10-19(11-9-16)22(26)24-14-20-12-21(23-25(20)13-17(24)2)27-15-18-6-4-3-5-7-18;1-15-9-17(11-18(22)10-15)21(26)24-7-8-25-19(13-24)12-20(23-25)27-14-16-5-3-2-4-6-16;1-27-19-8-7-16(11-18(19)22)21(26)24-9-10-25-17(13-24)12-20(23-25)28-14-15-5-3-2-4-6-15;1-15-7-8-18(19(22)11-15)21(26)24-9-10-25-17(13-24)12-20(23-25)27-14-16-5-3-2-4-6-16;2*1-16-6-5-9-18(12-16)21(25)23-10-11-24-19(14-23)13-20(22-24)26-15-17-7-3-2-4-8-17/h2-6,9-12H,7-8,14-15H2,1H3;2-10,13H,11-12,14-16H2,1H3;3-12,17H,13-15H2,1-2H3;2-6,9-12H,7-8,13-14H2,1H3;2-8,11-12H,9-10,13-14H2,1H3;2-8,11-12H,9-10,13-14H2,1H3;2*2-9,12-13H,10-11,14-15H2,1H3/t;;17-;;;;;/m..1...../s1
• InChIKey: SKXZRRDHSXJQMW-BEDNLVKSSA-N
• XLogP: 28.14
• TPSA: 421.13 Ų
• H-Bond Acceptors: 35
• Rotatable Bonds: 35
• Heavy Atoms: 217
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2934.83
LogP ≤ 5	28.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	35

Frequently Asked Questions

What is the IUPAC name of (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone)?

The IUPAC name of (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone) (CID 160864582) is (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone).

What is the SMILES notation for (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone)?

The canonical SMILES for (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone) is COCc1ccccc1C(=O)N1CCn2nc(OCc3ccccc3)cc2C1.COc1ccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)cc1F.Cc1cc(C#N)cc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1.Cc1cc(Cl)cc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1.Cc1ccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c(F)c1.Cc1ccc(C(=O)N2Cc3cc(OCc4ccccc4)nn3C[C@H]2C)cc1.Cc1cccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1.Cc1cccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1.

What is the InChIKey of (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone)?

The InChIKey is SKXZRRDHSXJQMW-BEDNLVKSSA-N. The full InChI is InChI=1S/C22H20N4O2.C22H23N3O3.C22H23N3O2.C21H20ClN3O2.C21H20FN3O3.C21H20FN3O2.2C21H21N3O2/c1-16-9-18(13-23)11-19(10-16)22(27)25-7-8-26-20(14-25)12-21(24-26)28-15-17-5-3-2-4-6-17;1-27-16-18-9-5-6-10-20(18)22(26)24-11-12-25-19(14-24)13-21(23-25)28-15-17-7-3-2-4-8-17;1-16-8-10-19(11-9-16)22(26)24-14-20-12-21(23-25(20)13-17(24)2)27-15-18-6-4-3-5-7-18;1-15-9-17(11-18(22)10-15)21(26)24-7-8-25-19(13-24)12-20(23-25)27-14-16-5-3-2-4-6-16;1-27-19-8-7-16(11-18(19)22)21(26)24-9-10-25-17(13-24)12-20(23-25)28-14-15-5-3-2-4-6-15;1-15-7-8-18(19(22)11-15)21(26)24-9-10-25-17(13-24)12-20(23-25)27-14-16-5-3-2-4-6-16;2*1-16-6-5-9-18(12-16)21(25)23-10-11-24-19(14-23)13-20(22-24)26-15-17-7-3-2-4-8-17/h2-6,9-12H,7-8,14-15H2,1H3;2-10,13H,11-12,14-16H2,1H3;3-12,17H,13-15H2,1-2H3;2-6,9-12H,7-8,13-14H2,1H3;2-8,11-12H,9-10,13-14H2,1H3;2-8,11-12H,9-10,13-14H2,1H3;2*2-9,12-13H,10-11,14-15H2,1H3/t;;17-;;;;;/m..1...../s1.

What are the key properties of (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone)?

(3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone) has a molecular weight of 2934.83 g/mol, XLogP of 28.14, 35 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for (3-chloro-5-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-4-methoxyphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-fluoro-4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-(methoxymethyl)phenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;3-methyl-5-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)benzonitrile;(4-methylphenyl)-[(6R)-6-methyl-2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;bis((3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone) is sourced from PubChem (CID 160864582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).