3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine

C91H97N35OS3 — CID 159323472

IUPAC3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCC(C)c1ccc(Nc2nccn3c(-c4cnn(C)c4)cnc23)cc1.Cc1cc(Nc2nc(C3CCCNC3)cn3c(-c4cnn(C)c4)cnc23)sn1.Cn1cc(-c2cnc3c(Nc4cc(C5CCCNC5)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4cc(C5CCNCC5)cs4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(O)cc4)nccn23)cn1
InChIInChI=1S/C19H22N8S.C19H21N7S.C19H20N6.C18H20N8S.C16H14N6O/c1-12-6-17(28-25-12)24-18-19-21-9-16(14-8-22-26(2)10-14)27(19)11-15(23-18)13-4-3-5-20-7-13;1-25-11-15(9-23-25)16-10-22-19-18(21-6-7-26(16)19)24-17-8-14(12-27-17)13-2-4-20-5-3-13;1-13(2)14-4-6-16(7-5-14)23-18-19-21-11-17(25(19)9-8-20-18)15-10-22-24(3)12-15;1-25-11-13(9-22-25)15-10-21-18-17(20-5-6-26(15)18)23-16-7-14(24-27-16)12-3-2-4-19-8-12;1-21-10-11(8-19-21)14-9-18-16-15(17-6-7-22(14)16)20-12-2-4-13(23)5-3-12/h6,8-11,13,20H,3-5,7H2,1-2H3,(H,23,24);6-13,20H,2-5H2,1H3,(H,21,24);4-13H,1-3H3,(H,20,23);5-7,9-12,19H,2-4,8H2,1H3,(H,20,23);2-10,23H,1H3,(H,17,20)
InChIKeyLEBHEVQWAXWORH-UHFFFAOYSA-N
MW1793.22 g/mol
LogP15.88
Rot. Bonds19

About 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine

3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 159323472) has the molecular formula C91H97N35OS3 and a molecular weight of 1793.22 g/mol. Its IUPAC name is 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID159323472
Molecular FormulaC91H97N35OS3
Molecular Weight1793.22 g/mol
Exact Mass1791.78
IUPAC Name3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCC(C)c1ccc(Nc2nccn3c(-c4cnn(C)c4)cnc23)cc1.Cc1cc(Nc2nc(C3CCCNC3)cn3c(-c4cnn(C)c4)cnc23)sn1.Cn1cc(-c2cnc3c(Nc4cc(C5CCCNC5)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4cc(C5CCNCC5)cs4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(O)cc4)nccn23)cn1
InChIInChI=1S/C19H22N8S.C19H21N7S.C19H20N6.C18H20N8S.C16H14N6O/c1-12-6-17(28-25-12)24-18-19-21-9-16(14-8-22-26(2)10-14)27(19)11-15(23-18)13-4-3-5-20-7-13;1-25-11-15(9-23-25)16-10-22-19-18(21-6-7-26(16)19)24-17-8-14(12-27-17)13-2-4-20-5-3-13;1-13(2)14-4-6-16(7-5-14)23-18-19-21-11-17(25(19)9-8-20-18)15-10-22-24(3)12-15;1-25-11-13(9-22-25)15-10-21-18-17(20-5-6-26(15)18)23-16-7-14(24-27-16)12-3-2-4-19-8-12;1-21-10-11(8-19-21)14-9-18-16-15(17-6-7-22(14)16)20-12-2-4-13(23)5-3-12/h6,8-11,13,20H,3-5,7H2,1-2H3,(H,23,24);6-13,20H,2-5H2,1H3,(H,21,24);4-13H,1-3H3,(H,20,23);5-7,9-12,19H,2-4,8H2,1H3,(H,20,23);2-10,23H,1H3,(H,17,20)
InChIKeyLEBHEVQWAXWORH-UHFFFAOYSA-N
XLogP15.88
TPSA382.30 Ų
H-Bond Donors9
H-Bond Acceptors39
Rotatable Bonds19
Heavy Atoms130
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001793.22
LogP ≤ 515.88
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

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

Analyze 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine (CID 159323472) is 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine is CC(C)c1ccc(Nc2nccn3c(-c4cnn(C)c4)cnc23)cc1.Cc1cc(Nc2nc(C3CCCNC3)cn3c(-c4cnn(C)c4)cnc23)sn1.Cn1cc(-c2cnc3c(Nc4cc(C5CCCNC5)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4cc(C5CCNCC5)cs4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(O)cc4)nccn23)cn1.
What is the InChIKey of 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is LEBHEVQWAXWORH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N8S.C19H21N7S.C19H20N6.C18H20N8S.C16H14N6O/c1-12-6-17(28-25-12)24-18-19-21-9-16(14-8-22-26(2)10-14)27(19)11-15(23-18)13-4-3-5-20-7-13;1-25-11-15(9-23-25)16-10-22-19-18(21-6-7-26(16)19)24-17-8-14(12-27-17)13-2-4-20-5-3-13;1-13(2)14-4-6-16(7-5-14)23-18-19-21-11-17(25(19)9-8-20-18)15-10-22-24(3)12-15;1-25-11-13(9-22-25)15-10-21-18-17(20-5-6-26(15)18)23-16-7-14(24-27-16)12-3-2-4-19-8-12;1-21-10-11(8-19-21)14-9-18-16-15(17-6-7-22(14)16)20-12-2-4-13(23)5-3-12/h6,8-11,13,20H,3-5,7H2,1-2H3,(H,23,24);6-13,20H,2-5H2,1H3,(H,21,24);4-13H,1-3H3,(H,20,23);5-7,9-12,19H,2-4,8H2,1H3,(H,20,23);2-10,23H,1H3,(H,17,20).
What are the key properties of 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine?
3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 1793.22 g/mol, XLogP of 15.88, 19 rotatable bonds, 9 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[3-(1-methylpyrazol-4-yl)-6-piperidin-3-ylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;4-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenol;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-piperidin-3-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-piperidin-4-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 159323472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).