N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine

C176H210F7N45O9 — CID 161212178

IUPACN-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCC(Cc1ccc(F)cc1)OC1CCC(Nc2ncnc3[nH]ncc23)CC1.CC(Cc1ccccc1F)OC1CCC(Nc2ncnc3[nH]ncc23)CC1.Cc1ccc(CCOC2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1.Cc1ccccc1CCOC1CCC(Nc2ncnc3[nH]ncc23)CC1.FC(COC1CCC(Nc2ncnc3[nH]ncc23)CC1)c1ccccc1.FC(F)(COC1CCC(Nc2ncnc3[nH]ncc23)CC1)c1ccccc1.Fc1ccc(CCOC2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1.Fc1ccccc1CCOC1CCC(Nc2ncnc3[nH]ncc23)CC1.c1ccc(CCCOC2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1
InChIInChI=1S/2C20H24FN5O.3C20H25N5O.C19H21F2N5O.3C19H22FN5O/c1-13(10-14-2-4-15(21)5-3-14)27-17-8-6-16(7-9-17)25-19-18-11-24-26-20(18)23-12-22-19;1-13(10-14-4-2-3-5-18(14)21)27-16-8-6-15(7-9-16)25-19-17-11-24-26-20(17)23-12-22-19;1-14-2-4-15(5-3-14)10-11-26-17-8-6-16(7-9-17)24-19-18-12-23-25-20(18)22-13-21-19;1-14-4-2-3-5-15(14)10-11-26-17-8-6-16(7-9-17)24-19-18-12-23-25-20(18)22-13-21-19;1-2-5-15(6-3-1)7-4-12-26-17-10-8-16(9-11-17)24-19-18-13-23-25-20(18)22-14-21-19;20-19(21,13-4-2-1-3-5-13)11-27-15-8-6-14(7-9-15)25-17-16-10-24-26-18(16)23-12-22-17;20-14-3-1-13(2-4-14)9-10-26-16-7-5-15(6-8-16)24-18-17-11-23-25-19(17)22-12-21-18;20-17-4-2-1-3-13(17)9-10-26-15-7-5-14(6-8-15)24-18-16-11-23-25-19(16)22-12-21-18;20-17(13-4-2-1-3-5-13)11-26-15-8-6-14(7-9-15)24-18-16-10-23-25-19(16)22-12-21-18/h2-5,11-13,16-17H,6-10H2,1H3,(H2,22,23,24,25,26);2-5,11-13,15-16H,6-10H2,1H3,(H2,22,23,24,25,26);2*2-5,12-13,16-17H,6-11H2,1H3,(H2,21,22,23,24,25);1-3,5-6,13-14,16-17H,4,7-12H2,(H2,21,22,23,24,25);1-5,10,12,14-15H,6-9,11H2,(H2,22,23,24,25,26);1-4,11-12,15-16H,5-10H2,(H2,21,22,23,24,25);1-4,11-12,14-15H,5-10H2,(H2,21,22,23,24,25);1-5,10,12,14-15,17H,6-9,11H2,(H2,21,22,23,24,25)
InChIKeyUWJQAJVLJSGEKJ-UHFFFAOYSA-N
MW3232.91 g/mol
LogP33.38
Rot. Bonds55

About N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine

N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 161212178) has the molecular formula C176H210F7N45O9 and a molecular weight of 3232.91 g/mol. Its IUPAC name is N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID161212178
Molecular FormulaC176H210F7N45O9
Molecular Weight3232.91 g/mol
Exact Mass3230.72
IUPAC NameN-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCC(Cc1ccc(F)cc1)OC1CCC(Nc2ncnc3[nH]ncc23)CC1.CC(Cc1ccccc1F)OC1CCC(Nc2ncnc3[nH]ncc23)CC1.Cc1ccc(CCOC2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1.Cc1ccccc1CCOC1CCC(Nc2ncnc3[nH]ncc23)CC1.FC(COC1CCC(Nc2ncnc3[nH]ncc23)CC1)c1ccccc1.FC(F)(COC1CCC(Nc2ncnc3[nH]ncc23)CC1)c1ccccc1.Fc1ccc(CCOC2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1.Fc1ccccc1CCOC1CCC(Nc2ncnc3[nH]ncc23)CC1.c1ccc(CCCOC2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1
InChIInChI=1S/2C20H24FN5O.3C20H25N5O.C19H21F2N5O.3C19H22FN5O/c1-13(10-14-2-4-15(21)5-3-14)27-17-8-6-16(7-9-17)25-19-18-11-24-26-20(18)23-12-22-19;1-13(10-14-4-2-3-5-18(14)21)27-16-8-6-15(7-9-16)25-19-17-11-24-26-20(17)23-12-22-19;1-14-2-4-15(5-3-14)10-11-26-17-8-6-16(7-9-17)24-19-18-12-23-25-20(18)22-13-21-19;1-14-4-2-3-5-15(14)10-11-26-17-8-6-16(7-9-17)24-19-18-12-23-25-20(18)22-13-21-19;1-2-5-15(6-3-1)7-4-12-26-17-10-8-16(9-11-17)24-19-18-13-23-25-20(18)22-14-21-19;20-19(21,13-4-2-1-3-5-13)11-27-15-8-6-14(7-9-15)25-17-16-10-24-26-18(16)23-12-22-17;20-14-3-1-13(2-4-14)9-10-26-16-7-5-15(6-8-16)24-18-17-11-23-25-19(17)22-12-21-18;20-17-4-2-1-3-13(17)9-10-26-15-7-5-14(6-8-15)24-18-16-11-23-25-19(16)22-12-21-18;20-17(13-4-2-1-3-5-13)11-26-15-8-6-14(7-9-15)24-18-16-10-23-25-19(16)22-12-21-18/h2-5,11-13,16-17H,6-10H2,1H3,(H2,22,23,24,25,26);2-5,11-13,15-16H,6-10H2,1H3,(H2,22,23,24,25,26);2*2-5,12-13,16-17H,6-11H2,1H3,(H2,21,22,23,24,25);1-3,5-6,13-14,16-17H,4,7-12H2,(H2,21,22,23,24,25);1-5,10,12,14-15H,6-9,11H2,(H2,22,23,24,25,26);1-4,11-12,15-16H,5-10H2,(H2,21,22,23,24,25);1-4,11-12,14-15H,5-10H2,(H2,21,22,23,24,25);1-5,10,12,14-15,17H,6-9,11H2,(H2,21,22,23,24,25)
InChIKeyUWJQAJVLJSGEKJ-UHFFFAOYSA-N
XLogP33.38
TPSA681.48 Ų
H-Bond Donors18
H-Bond Acceptors45
Rotatable Bonds55
Heavy Atoms237
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003232.91
LogP ≤ 533.38
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1045

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine (CID 161212178) is N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine is CC(Cc1ccc(F)cc1)OC1CCC(Nc2ncnc3[nH]ncc23)CC1.CC(Cc1ccccc1F)OC1CCC(Nc2ncnc3[nH]ncc23)CC1.Cc1ccc(CCOC2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1.Cc1ccccc1CCOC1CCC(Nc2ncnc3[nH]ncc23)CC1.FC(COC1CCC(Nc2ncnc3[nH]ncc23)CC1)c1ccccc1.FC(F)(COC1CCC(Nc2ncnc3[nH]ncc23)CC1)c1ccccc1.Fc1ccc(CCOC2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1.Fc1ccccc1CCOC1CCC(Nc2ncnc3[nH]ncc23)CC1.c1ccc(CCCOC2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1.
What is the InChIKey of N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is UWJQAJVLJSGEKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H24FN5O.3C20H25N5O.C19H21F2N5O.3C19H22FN5O/c1-13(10-14-2-4-15(21)5-3-14)27-17-8-6-16(7-9-17)25-19-18-11-24-26-20(18)23-12-22-19;1-13(10-14-4-2-3-5-18(14)21)27-16-8-6-15(7-9-16)25-19-17-11-24-26-20(17)23-12-22-19;1-14-2-4-15(5-3-14)10-11-26-17-8-6-16(7-9-17)24-19-18-12-23-25-20(18)22-13-21-19;1-14-4-2-3-5-15(14)10-11-26-17-8-6-16(7-9-17)24-19-18-12-23-25-20(18)22-13-21-19;1-2-5-15(6-3-1)7-4-12-26-17-10-8-16(9-11-17)24-19-18-13-23-25-20(18)22-14-21-19;20-19(21,13-4-2-1-3-5-13)11-27-15-8-6-14(7-9-15)25-17-16-10-24-26-18(16)23-12-22-17;20-14-3-1-13(2-4-14)9-10-26-16-7-5-15(6-8-16)24-18-17-11-23-25-19(17)22-12-21-18;20-17-4-2-1-3-13(17)9-10-26-15-7-5-14(6-8-15)24-18-16-11-23-25-19(16)22-12-21-18;20-17(13-4-2-1-3-5-13)11-26-15-8-6-14(7-9-15)24-18-16-10-23-25-19(16)22-12-21-18/h2-5,11-13,16-17H,6-10H2,1H3,(H2,22,23,24,25,26);2-5,11-13,15-16H,6-10H2,1H3,(H2,22,23,24,25,26);2*2-5,12-13,16-17H,6-11H2,1H3,(H2,21,22,23,24,25);1-3,5-6,13-14,16-17H,4,7-12H2,(H2,21,22,23,24,25);1-5,10,12,14-15H,6-9,11H2,(H2,22,23,24,25,26);1-4,11-12,15-16H,5-10H2,(H2,21,22,23,24,25);1-4,11-12,14-15H,5-10H2,(H2,21,22,23,24,25);1-5,10,12,14-15,17H,6-9,11H2,(H2,21,22,23,24,25).
What are the key properties of N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 3232.91 g/mol, XLogP of 33.38, 55 rotatable bonds, 18 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,2-difluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(2-fluoro-2-phenylethoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-fluorophenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(2-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[1-(4-fluorophenyl)propan-2-yloxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(2-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-[2-(4-methylphenyl)ethoxy]cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine;N-[4-(3-phenylpropoxy)cyclohexyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 161212178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).