2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C73H80Cl2F4N32O10 — CID 160730565

About 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 160730565) has the molecular formula C73H80Cl2F4N32O10 and a molecular weight of 1712.55 g/mol. Its IUPAC name is 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

• Compound Name: 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
• PubChem CID: 160730565
• Molecular Formula: C73H80Cl2F4N32O10
• Molecular Weight: 1712.55 g/mol
• Exact Mass: 1710.60
• IUPAC Name: 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
• SMILES: CN1CCC(Oc2ncncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)CC1.CN1CCC(Oc2ncncc2NC(=O)c2c(N)nn3ccc(C(F)(F)F)nc23)CC1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cncnc1OC1CCN(C2COC2)CC1.Nc1nn2cc(F)cnc2c1C(=O)Nc1cncnc1OC1CCN(C2COC2)CC1
• InChI: InChI=1S/C19H21ClN8O3.C19H21FN8O3.C18H19F3N8O2.C17H19ClN8O2/c2*20-11-5-23-17-15(16(21)26-28(17)7-11)18(29)25-14-6-22-10-24-19(14)31-13-1-3-27(4-2-13)12-8-30-9-12;1-28-5-2-10(3-6-28)31-17-11(8-23-9-24-17)25-16(30)13-14(22)27-29-7-4-12(18(19,20)21)26-15(13)29;1-25-4-2-11(3-5-25)28-17-12(7-20-9-22-17)23-16(27)13-14(19)24-26-8-10(18)6-21-15(13)26/h2*5-7,10,12-13H,1-4,8-9H2,(H2,21,26)(H,25,29);4,7-10H,2-3,5-6H2,1H3,(H2,22,27)(H,25,30);6-9,11H,2-5H2,1H3,(H2,19,24)(H,23,27)
• InChIKey: RUGYOPSJLFBADK-UHFFFAOYSA-N
• XLogP: 5.31
• TPSA: 512.70 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 38
• Rotatable Bonds: 18
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1712.55
LogP ≤ 5	5.31
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	38

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The IUPAC name of 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 160730565) is 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

What is the SMILES notation for 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The canonical SMILES for 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CN1CCC(Oc2ncncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)CC1.CN1CCC(Oc2ncncc2NC(=O)c2c(N)nn3ccc(C(F)(F)F)nc23)CC1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cncnc1OC1CCN(C2COC2)CC1.Nc1nn2cc(F)cnc2c1C(=O)Nc1cncnc1OC1CCN(C2COC2)CC1.

What is the InChIKey of 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The InChIKey is RUGYOPSJLFBADK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN8O3.C19H21FN8O3.C18H19F3N8O2.C17H19ClN8O2/c2*20-11-5-23-17-15(16(21)26-28(17)7-11)18(29)25-14-6-22-10-24-19(14)31-13-1-3-27(4-2-13)12-8-30-9-12;1-28-5-2-10(3-6-28)31-17-11(8-23-9-24-17)25-16(30)13-14(22)27-29-7-4-12(18(19,20)21)26-15(13)29;1-25-4-2-11(3-5-25)28-17-12(7-20-9-22-17)23-16(27)13-14(19)24-26-8-10(18)6-21-15(13)26/h2*5-7,10,12-13H,1-4,8-9H2,(H2,21,26)(H,25,29);4,7-10H,2-3,5-6H2,1H3,(H2,22,27)(H,25,30);6-9,11H,2-5H2,1H3,(H2,19,24)(H,23,27).

What are the key properties of 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?

2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 1712.55 g/mol, XLogP of 5.31, 18 rotatable bonds, 8 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-6-chloro-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-[1-(oxetan-3-yl)piperidin-4-yl]oxypyrimidin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 160730565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).