2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate

C65H93BClN21O15 — CID 159773803

About 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate

2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate (PubChem CID 159773803) has the molecular formula C65H93BClN21O15 and a molecular weight of 1454.86 g/mol. Its IUPAC name is 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate.

Molecular Properties

• Compound Name: 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate
• PubChem CID: 159773803
• Molecular Formula: C65H93BClN21O15
• Molecular Weight: 1454.86 g/mol
• Exact Mass: 1453.69
• IUPAC Name: 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate
• SMILES: CC(C)(C)OC(=O)N1CCC(Oc2cc(Cl)nc(N3CCOCC3)n2)CC1.COC(=O)N1CCC(Oc2cc(-c3cnc(N)[nH]c3=O)nc(N3CCOCC3)n2)CC1.COc1nc(N)ncc1B1OC(C)(C)C(C)(C)O1.Nc1ncc(-c2cc(OC3CCNCC3)nc(N3CCOCC3)n2)c(=O)[nH]1
• InChI: InChI=1S/C19H25N7O5.C18H27ClN4O4.C17H23N7O3.C11H18BN3O3/c1-29-19(28)26-4-2-12(3-5-26)31-15-10-14(13-11-21-17(20)24-16(13)27)22-18(23-15)25-6-8-30-9-7-25;1-18(2,3)27-17(24)23-6-4-13(5-7-23)26-15-12-14(19)20-16(21-15)22-8-10-25-11-9-22;18-16-20-10-12(15(25)23-16)13-9-14(27-11-1-3-19-4-2-11)22-17(21-13)24-5-7-26-8-6-24;1-10(2)11(3,4)18-12(17-10)7-6-14-9(13)15-8(7)16-5/h10-12H,2-9H2,1H3,(H3,20,21,24,27);12-13H,4-11H2,1-3H3;9-11,19H,1-8H2,(H3,18,20,23,25);6H,1-5H3,(H2,13,14,15)
• InChIKey: NGLTUOJCEXQMMM-UHFFFAOYSA-N
• XLogP: 3.14
• TPSA: 436.58 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 32
• Rotatable Bonds: 13
• Heavy Atoms: 103
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1454.86
LogP ≤ 5	3.14
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate?

The IUPAC name of 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate (CID 159773803) is 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate.

What is the SMILES notation for 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate?

The canonical SMILES for 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate is CC(C)(C)OC(=O)N1CCC(Oc2cc(Cl)nc(N3CCOCC3)n2)CC1.COC(=O)N1CCC(Oc2cc(-c3cnc(N)[nH]c3=O)nc(N3CCOCC3)n2)CC1.COc1nc(N)ncc1B1OC(C)(C)C(C)(C)O1.Nc1ncc(-c2cc(OC3CCNCC3)nc(N3CCOCC3)n2)c(=O)[nH]1.

What is the InChIKey of 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate?

The InChIKey is NGLTUOJCEXQMMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N7O5.C18H27ClN4O4.C17H23N7O3.C11H18BN3O3/c1-29-19(28)26-4-2-12(3-5-26)31-15-10-14(13-11-21-17(20)24-16(13)27)22-18(23-15)25-6-8-30-9-7-25;1-18(2,3)27-17(24)23-6-4-13(5-7-23)26-15-12-14(19)20-16(21-15)22-8-10-25-11-9-22;18-16-20-10-12(15(25)23-16)13-9-14(27-11-1-3-19-4-2-11)22-17(21-13)24-5-7-26-8-6-24;1-10(2)11(3,4)18-12(17-10)7-6-14-9(13)15-8(7)16-5/h10-12H,2-9H2,1H3,(H3,20,21,24,27);12-13H,4-11H2,1-3H3;9-11,19H,1-8H2,(H3,18,20,23,25);6H,1-5H3,(H2,13,14,15).

What are the key properties of 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate?

2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate has a molecular weight of 1454.86 g/mol, XLogP of 3.14, 13 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-5-(2-morpholin-4-yl-6-piperidin-4-yloxypyrimidin-4-yl)-1H-pyrimidin-6-one;tert-butyl 4-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)oxypiperidine-1-carboxylate;4-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;methyl 4-[6-(2-amino-6-oxo-1H-pyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxypiperidine-1-carboxylate is sourced from PubChem (CID 159773803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).