4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine

C86H106N30O2S — CID 161066707

IUPAC4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine
SMILESCC(C)n1cc(-c2nc(-c3cnn(C4CCNCC4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(C4CCNCC4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(CC4CCCC4)c3)cn3nccc23)cn1.CC[C@@H](C)n1cc(-c2nc(-c3cnn(C4CCS(=O)(=O)CC4)c3)cn3nccc23)cn1
InChIInChI=1S/C23H29N7.C22H28N8.C21H25N7O2S.C20H24N8/c1-3-20(4-2)29-15-19(12-26-29)23-22-9-10-24-30(22)16-21(27-23)18-11-25-28(14-18)13-17-7-5-6-8-17;1-3-18(4-2)28-14-17(12-26-28)22-21-7-10-24-30(21)15-20(27-22)16-11-25-29(13-16)19-5-8-23-9-6-19;1-3-15(2)26-13-17(11-23-26)21-20-4-7-22-28(20)14-19(25-21)16-10-24-27(12-16)18-5-8-31(29,30)9-6-18;1-14(2)26-12-16(10-23-26)20-19-5-8-22-28(19)13-18(25-20)15-9-24-27(11-15)17-3-6-21-7-4-17/h9-12,14-17,20H,3-8,13H2,1-2H3;7,10-15,18-19,23H,3-6,8-9H2,1-2H3;4,7,10-15,18H,3,5-6,8-9H2,1-2H3;5,8-14,17,21H,3-4,6-7H2,1-2H3/t;;15-;/m..1./s1
InChIKeyUECQCGVJYZSDTC-INFGGBCXSA-N
MW1624.07 g/mol
LogP14.89
Rot. Bonds22

About 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine

4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine (PubChem CID 161066707) has the molecular formula C86H106N30O2S and a molecular weight of 1624.07 g/mol. Its IUPAC name is 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine
PubChem CID161066707
Molecular FormulaC86H106N30O2S
Molecular Weight1624.07 g/mol
Exact Mass1622.88
IUPAC Name4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine
SMILESCC(C)n1cc(-c2nc(-c3cnn(C4CCNCC4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(C4CCNCC4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(CC4CCCC4)c3)cn3nccc23)cn1.CC[C@@H](C)n1cc(-c2nc(-c3cnn(C4CCS(=O)(=O)CC4)c3)cn3nccc23)cn1
InChIInChI=1S/C23H29N7.C22H28N8.C21H25N7O2S.C20H24N8/c1-3-20(4-2)29-15-19(12-26-29)23-22-9-10-24-30(22)16-21(27-23)18-11-25-28(14-18)13-17-7-5-6-8-17;1-3-18(4-2)28-14-17(12-26-28)22-21-7-10-24-30(21)15-20(27-22)16-11-25-29(13-16)19-5-8-23-9-6-19;1-3-15(2)26-13-17(11-23-26)21-20-4-7-22-28(20)14-19(25-21)16-10-24-27(12-16)18-5-8-31(29,30)9-6-18;1-14(2)26-12-16(10-23-26)20-19-5-8-22-28(19)13-18(25-20)15-9-24-27(11-15)17-3-6-21-7-4-17/h9-12,14-17,20H,3-8,13H2,1-2H3;7,10-15,18-19,23H,3-6,8-9H2,1-2H3;4,7,10-15,18H,3,5-6,8-9H2,1-2H3;5,8-14,17,21H,3-4,6-7H2,1-2H3/t;;15-;/m..1./s1
InChIKeyUECQCGVJYZSDTC-INFGGBCXSA-N
XLogP14.89
TPSA321.52 Ų
H-Bond Donors2
H-Bond Acceptors32
Rotatable Bonds22
Heavy Atoms119
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001624.07
LogP ≤ 514.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1032

Analyze 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

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4-[4-[4-(1-Butan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide
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N-[6-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]-3-pyridinyl]-3-[[6-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]-3-pyridinyl]amino]butane-1-sulfonamide
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5-[(2E,4E)-5-[(3-methylpyrrolidin-1-yl)methyl]hepta-2,4,6-trien-3-yl]-3-(4-thiophen-2-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine;N-(1-phenylethenyl)-5-[3-(4-thiophen-2-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-amine
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4-[[4-[4-(1-Pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]methyl]thiane 1-oxide
CID 156032567
1-methylpyrazolo[5,4-c]pyridine;2-methylpyrazolo[3,4-c]pyridine;1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine;2-methyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine;1H-pyrazolo[5,4-c]pyridine
CID 157214190
N,N-dimethyl-2-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]acetamide;6-[1-(2-methylsulfonylethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-[1-(3-methylsulfonylpropyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine
CID 157366489
4-(1-pentan-3-ylpyrazol-4-yl)-6-[1-[(3R)-piperidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazine;(3S)-3-[[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]methyl]morpholine;4-(1-pentan-3-ylpyrazol-4-yl)-6-[1-[[(2S)-pyrrolidin-2-yl]methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazine
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6-[1-(Oxan-4-ylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-[2-[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]ethyl]morpholine;5-[[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]methyl]-1,3-oxazolidin-2-one;4-[[4-[4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]methyl]thiane 1,1-dioxide
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Frequently Asked Questions

What is the IUPAC name of 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine?
The IUPAC name of 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine (CID 161066707) is 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine?
The canonical SMILES for 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine is CC(C)n1cc(-c2nc(-c3cnn(C4CCNCC4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(C4CCNCC4)c3)cn3nccc23)cn1.CCC(CC)n1cc(-c2nc(-c3cnn(CC4CCCC4)c3)cn3nccc23)cn1.CC[C@@H](C)n1cc(-c2nc(-c3cnn(C4CCS(=O)(=O)CC4)c3)cn3nccc23)cn1.
What is the InChIKey of 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine?
The InChIKey is UECQCGVJYZSDTC-INFGGBCXSA-N. The full InChI is InChI=1S/C23H29N7.C22H28N8.C21H25N7O2S.C20H24N8/c1-3-20(4-2)29-15-19(12-26-29)23-22-9-10-24-30(22)16-21(27-23)18-11-25-28(14-18)13-17-7-5-6-8-17;1-3-18(4-2)28-14-17(12-26-28)22-21-7-10-24-30(21)15-20(27-22)16-11-25-29(13-16)19-5-8-23-9-6-19;1-3-15(2)26-13-17(11-23-26)21-20-4-7-22-28(20)14-19(25-21)16-10-24-27(12-16)18-5-8-31(29,30)9-6-18;1-14(2)26-12-16(10-23-26)20-19-5-8-22-28(19)13-18(25-20)15-9-24-27(11-15)17-3-6-21-7-4-17/h9-12,14-17,20H,3-8,13H2,1-2H3;7,10-15,18-19,23H,3-6,8-9H2,1-2H3;4,7,10-15,18H,3,5-6,8-9H2,1-2H3;5,8-14,17,21H,3-4,6-7H2,1-2H3/t;;15-;/m..1./s1.
What are the key properties of 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine?
4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine has a molecular weight of 1624.07 g/mol, XLogP of 14.89, 22 rotatable bonds, 2 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[4-[1-[(2R)-butan-2-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-6-yl]pyrazol-1-yl]thiane 1,1-dioxide;6-[1-(cyclopentylmethyl)pyrazol-4-yl]-4-(1-pentan-3-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;4-(1-pentan-3-ylpyrazol-4-yl)-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine;6-(1-piperidin-4-ylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 161066707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).