3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine

C70H73N31OS2 — CID 158176344

IUPAC3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine
SMILESCC(C)c1cc(Nc2nccn3c(-c4cnn(C)c4)cnc23)sn1.Cn1cc(-c2cnc3c(Nc4cc(C5CC5)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccnc(N5CCNCC5)c4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccnc(O[C@@H]5CCNC5)c4)nccn23)cn1
InChIInChI=1S/C19H21N9.C19H20N8O.C16H15N7S.C16H17N7S/c1-26-13-14(11-24-26)16-12-23-19-18(22-6-9-28(16)19)25-15-2-3-21-17(10-15)27-7-4-20-5-8-27;1-26-12-13(9-24-26)16-11-23-19-18(22-6-7-27(16)19)25-14-2-5-21-17(8-14)28-15-3-4-20-10-15;1-22-9-11(7-19-22)13-8-18-16-15(17-4-5-23(13)16)20-14-6-12(21-24-14)10-2-3-10;1-10(2)12-6-14(24-21-12)20-15-16-18-8-13(23(16)5-4-17-15)11-7-19-22(3)9-11/h2-3,6,9-13,20H,4-5,7-8H2,1H3,(H,21,22,25);2,5-9,11-12,15,20H,3-4,10H2,1H3,(H,21,22,25);4-10H,2-3H2,1H3,(H,17,20);4-10H,1-3H3,(H,17,20)/t;15-;;/m.1../s1
InChIKeyFYAUJVOCJTYRGK-FTBZCSGFSA-N
MW1428.70 g/mol
LogP10.35
Rot. Bonds17

About 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine

3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine (PubChem CID 158176344) has the molecular formula C70H73N31OS2 and a molecular weight of 1428.70 g/mol. Its IUPAC name is 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine
PubChem CID158176344
Molecular FormulaC70H73N31OS2
Molecular Weight1428.70 g/mol
Exact Mass1427.61
IUPAC Name3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine
SMILESCC(C)c1cc(Nc2nccn3c(-c4cnn(C)c4)cnc23)sn1.Cn1cc(-c2cnc3c(Nc4cc(C5CC5)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccnc(N5CCNCC5)c4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccnc(O[C@@H]5CCNC5)c4)nccn23)cn1
InChIInChI=1S/C19H21N9.C19H20N8O.C16H15N7S.C16H17N7S/c1-26-13-14(11-24-26)16-12-23-19-18(22-6-9-28(16)19)25-15-2-3-21-17(10-15)27-7-4-20-5-8-27;1-26-12-13(9-24-26)16-11-23-19-18(22-6-7-27(16)19)25-14-2-5-21-17(8-14)28-15-3-4-20-10-15;1-22-9-11(7-19-22)13-8-18-16-15(17-4-5-23(13)16)20-14-6-12(21-24-14)10-2-3-10;1-10(2)12-6-14(24-21-12)20-15-16-18-8-13(23(16)5-4-17-15)11-7-19-22(3)9-11/h2-3,6,9-13,20H,4-5,7-8H2,1H3,(H,21,22,25);2,5-9,11-12,15,20H,3-4,10H2,1H3,(H,21,22,25);4-10H,2-3H2,1H3,(H,17,20);4-10H,1-3H3,(H,17,20)/t;15-;;/m.1../s1
InChIKeyFYAUJVOCJTYRGK-FTBZCSGFSA-N
XLogP10.35
TPSA328.25 Ų
H-Bond Donors6
H-Bond Acceptors34
Rotatable Bonds17
Heavy Atoms104
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001428.70
LogP ≤ 510.35
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1034

Analyze 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine (CID 158176344) is 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine is CC(C)c1cc(Nc2nccn3c(-c4cnn(C)c4)cnc23)sn1.Cn1cc(-c2cnc3c(Nc4cc(C5CC5)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccnc(N5CCNCC5)c4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccnc(O[C@@H]5CCNC5)c4)nccn23)cn1.
What is the InChIKey of 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is FYAUJVOCJTYRGK-FTBZCSGFSA-N. The full InChI is InChI=1S/C19H21N9.C19H20N8O.C16H15N7S.C16H17N7S/c1-26-13-14(11-24-26)16-12-23-19-18(22-6-9-28(16)19)25-15-2-3-21-17(10-15)27-7-4-20-5-8-27;1-26-12-13(9-24-26)16-11-23-19-18(22-6-7-27(16)19)25-14-2-5-21-17(8-14)28-15-3-4-20-10-15;1-22-9-11(7-19-22)13-8-18-16-15(17-4-5-23(13)16)20-14-6-12(21-24-14)10-2-3-10;1-10(2)12-6-14(24-21-12)20-15-16-18-8-13(23(16)5-4-17-15)11-7-19-22(3)9-11/h2-3,6,9-13,20H,4-5,7-8H2,1H3,(H,21,22,25);2,5-9,11-12,15,20H,3-4,10H2,1H3,(H,21,22,25);4-10H,2-3H2,1H3,(H,17,20);4-10H,1-3H3,(H,17,20)/t;15-;;/m.1../s1.
What are the key properties of 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine?
3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 1428.70 g/mol, XLogP of 10.35, 17 rotatable bonds, 6 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-propan-2-yl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(2-piperazin-1-yl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 158176344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).