2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone

C114H144F2N18O15 — CID 159019160

IUPAC2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone
SMILESCC(C)(C)CC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.CC(C)(C)COCC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.CC(C)OCC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.CC(F)(F)COCC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.O=C(C1CCCC1)N1CCn2nc(OCc3ccccc3)cc2C1.O=C(CC1CCCC1)N1CCn2nc(OCc3ccccc3)cc2C1
InChIInChI=1S/C20H27N3O3.C20H25N3O2.C19H23N3O2.C19H25N3O2.C18H21F2N3O3.C18H23N3O3/c1-20(2,3)15-25-14-19(24)22-9-10-23-17(12-22)11-18(21-23)26-13-16-7-5-4-6-8-16;24-20(12-16-6-4-5-7-16)22-10-11-23-18(14-22)13-19(21-23)25-15-17-8-2-1-3-9-17;23-19(16-8-4-5-9-16)21-10-11-22-17(13-21)12-18(20-22)24-14-15-6-2-1-3-7-15;1-19(2,3)12-18(23)21-9-10-22-16(13-21)11-17(20-22)24-14-15-7-5-4-6-8-15;1-18(19,20)13-25-12-17(24)22-7-8-23-15(10-22)9-16(21-23)26-11-14-5-3-2-4-6-14;1-14(2)23-13-18(22)20-8-9-21-16(11-20)10-17(19-21)24-12-15-6-4-3-5-7-15/h4-8,11H,9-10,12-15H2,1-3H3;1-3,8-9,13,16H,4-7,10-12,14-15H2;1-3,6-7,12,16H,4-5,8-11,13-14H2;4-8,11H,9-10,12-14H2,1-3H3;2-6,9H,7-8,10-13H2,1H3;3-7,10,14H,8-9,11-13H2,1-2H3
InChIKeyJTLVZBOIQBRFQU-UHFFFAOYSA-N
MW2044.51 g/mol
LogP17.19
Rot. Bonds32

About 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone

2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone (PubChem CID 159019160) has the molecular formula C114H144F2N18O15 and a molecular weight of 2044.51 g/mol. Its IUPAC name is 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone
PubChem CID159019160
Molecular FormulaC114H144F2N18O15
Molecular Weight2044.51 g/mol
Exact Mass2043.10
IUPAC Name2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone
SMILESCC(C)(C)CC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.CC(C)(C)COCC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.CC(C)OCC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.CC(F)(F)COCC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.O=C(C1CCCC1)N1CCn2nc(OCc3ccccc3)cc2C1.O=C(CC1CCCC1)N1CCn2nc(OCc3ccccc3)cc2C1
InChIInChI=1S/C20H27N3O3.C20H25N3O2.C19H23N3O2.C19H25N3O2.C18H21F2N3O3.C18H23N3O3/c1-20(2,3)15-25-14-19(24)22-9-10-23-17(12-22)11-18(21-23)26-13-16-7-5-4-6-8-16;24-20(12-16-6-4-5-7-16)22-10-11-23-18(14-22)13-19(21-23)25-15-17-8-2-1-3-9-17;23-19(16-8-4-5-9-16)21-10-11-22-17(13-21)12-18(20-22)24-14-15-6-2-1-3-7-15;1-19(2,3)12-18(23)21-9-10-22-16(13-21)11-17(20-22)24-14-15-7-5-4-6-8-15;1-18(19,20)13-25-12-17(24)22-7-8-23-15(10-22)9-16(21-23)26-11-14-5-3-2-4-6-14;1-14(2)23-13-18(22)20-8-9-21-16(11-20)10-17(19-21)24-12-15-6-4-3-5-7-15/h4-8,11H,9-10,12-15H2,1-3H3;1-3,8-9,13,16H,4-7,10-12,14-15H2;1-3,6-7,12,16H,4-5,8-11,13-14H2;4-8,11H,9-10,12-14H2,1-3H3;2-6,9H,7-8,10-13H2,1H3;3-7,10,14H,8-9,11-13H2,1-2H3
InChIKeyJTLVZBOIQBRFQU-UHFFFAOYSA-N
XLogP17.19
TPSA311.85 Ų
H-Bond Donors
H-Bond Acceptors27
Rotatable Bonds32
Heavy Atoms149
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002044.51
LogP ≤ 517.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1027

Analyze 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone?
The IUPAC name of 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone (CID 159019160) is 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone.
What is the SMILES notation for 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone?
The canonical SMILES for 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone is CC(C)(C)CC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.CC(C)(C)COCC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.CC(C)OCC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.CC(F)(F)COCC(=O)N1CCn2nc(OCc3ccccc3)cc2C1.O=C(C1CCCC1)N1CCn2nc(OCc3ccccc3)cc2C1.O=C(CC1CCCC1)N1CCn2nc(OCc3ccccc3)cc2C1.
What is the InChIKey of 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone?
The InChIKey is JTLVZBOIQBRFQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3.C20H25N3O2.C19H23N3O2.C19H25N3O2.C18H21F2N3O3.C18H23N3O3/c1-20(2,3)15-25-14-19(24)22-9-10-23-17(12-22)11-18(21-23)26-13-16-7-5-4-6-8-16;24-20(12-16-6-4-5-7-16)22-10-11-23-18(14-22)13-19(21-23)25-15-17-8-2-1-3-9-17;23-19(16-8-4-5-9-16)21-10-11-22-17(13-21)12-18(20-22)24-14-15-6-2-1-3-7-15;1-19(2,3)12-18(23)21-9-10-22-16(13-21)11-17(20-22)24-14-15-7-5-4-6-8-15;1-18(19,20)13-25-12-17(24)22-7-8-23-15(10-22)9-16(21-23)26-11-14-5-3-2-4-6-14;1-14(2)23-13-18(22)20-8-9-21-16(11-20)10-17(19-21)24-12-15-6-4-3-5-7-15/h4-8,11H,9-10,12-15H2,1-3H3;1-3,8-9,13,16H,4-7,10-12,14-15H2;1-3,6-7,12,16H,4-5,8-11,13-14H2;4-8,11H,9-10,12-14H2,1-3H3;2-6,9H,7-8,10-13H2,1H3;3-7,10,14H,8-9,11-13H2,1-2H3.
What are the key properties of 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone?
2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone has a molecular weight of 2044.51 g/mol, XLogP of 17.19, 32 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;cyclopentyl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;2-(2,2-difluoropropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;3,3-dimethyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)butan-1-one;2-(2,2-dimethylpropoxy)-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanone;1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-propan-2-yloxyethanone is sourced from PubChem (CID 159019160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).