(4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine

C111H136Cl4F3N33 — CID 165095701

About (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine

(4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine (PubChem CID 165095701) has the molecular formula C111H136Cl4F3N33 and a molecular weight of 2131.35 g/mol. Its IUPAC name is (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine.

Molecular Properties

• Compound Name: (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine
• PubChem CID: 165095701
• Molecular Formula: C111H136Cl4F3N33
• Molecular Weight: 2131.35 g/mol
• Exact Mass: 2128.04
• IUPAC Name: (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine
• SMILES: CNc1nccc(-c2c(C)nc(N3CCC4(CCC[C@H]4N)CC3)n3ccnc23)c1Cl.Cc1nc(N2CCC3(CCC[C@H]3N)CC2)n2ccnc2c1-c1cccnc1C(F)(F)F.Cc1nc(N2CCC3(CCC[C@H]3N)CC2)n2ccnc2c1-c1ccnc(N)c1Cl.Cc1nc(N2CCC3(CCC[C@H]3N)CC2)n2ccnc2c1-c1ccnc(NC2CC2)c1Cl.Cc1nccc(-c2c(C)nc(N3CCC4(CCC[C@H]4N)CC3)n3ccnc23)c1Cl
• InChI: InChI=1S/C24H30ClN7.C22H28ClN7.C22H27ClN6.C22H25F3N6.C21H26ClN7/c1-15-19(17-6-10-27-21(20(17)25)30-16-4-5-16)22-28-11-14-32(22)23(29-15)31-12-8-24(9-13-31)7-2-3-18(24)26;1-14-17(15-5-9-26-19(25-2)18(15)23)20-27-10-13-30(20)21(28-14)29-11-7-22(8-12-29)6-3-4-16(22)24;1-14-18(16-5-9-25-15(2)19(16)23)20-26-10-13-29(20)21(27-14)28-11-7-22(8-12-28)6-3-4-17(22)24;1-14-17(15-4-3-9-27-18(15)22(23,24)25)19-28-10-13-31(19)20(29-14)30-11-7-21(8-12-30)6-2-5-16(21)26;1-13-16(14-4-8-25-18(24)17(14)22)19-26-9-12-29(19)20(27-13)28-10-6-21(7-11-28)5-2-3-15(21)23/h6,10-11,14,16,18H,2-5,7-9,12-13,26H2,1H3,(H,27,30);5,9-10,13,16H,3-4,6-8,11-12,24H2,1-2H3,(H,25,26);5,9-10,13,17H,3-4,6-8,11-12,24H2,1-2H3;3-4,9-10,13,16H,2,5-8,11-12,26H2,1H3;4,8-9,12,15H,2-3,5-7,10-11,23H2,1H3,(H2,24,25)/t18-;16-;17-;16-;15-/m11111/s1
• InChIKey: XLTQWLRBJZKRLA-QWLFEBHFSA-N
• XLogP: 20.13
• TPSA: 411.78 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 33
• Rotatable Bonds: 13
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2131.35
LogP ≤ 5	20.13
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine?

The IUPAC name of (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine (CID 165095701) is (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine.

What is the SMILES notation for (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine?

The canonical SMILES for (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine is CNc1nccc(-c2c(C)nc(N3CCC4(CCC[C@H]4N)CC3)n3ccnc23)c1Cl.Cc1nc(N2CCC3(CCC[C@H]3N)CC2)n2ccnc2c1-c1cccnc1C(F)(F)F.Cc1nc(N2CCC3(CCC[C@H]3N)CC2)n2ccnc2c1-c1ccnc(N)c1Cl.Cc1nc(N2CCC3(CCC[C@H]3N)CC2)n2ccnc2c1-c1ccnc(NC2CC2)c1Cl.Cc1nccc(-c2c(C)nc(N3CCC4(CCC[C@H]4N)CC3)n3ccnc23)c1Cl.

What is the InChIKey of (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine?

The InChIKey is XLTQWLRBJZKRLA-QWLFEBHFSA-N. The full InChI is InChI=1S/C24H30ClN7.C22H28ClN7.C22H27ClN6.C22H25F3N6.C21H26ClN7/c1-15-19(17-6-10-27-21(20(17)25)30-16-4-5-16)22-28-11-14-32(22)23(29-15)31-12-8-24(9-13-31)7-2-3-18(24)26;1-14-17(15-5-9-26-19(25-2)18(15)23)20-27-10-13-30(20)21(28-14)29-11-7-22(8-12-29)6-3-4-16(22)24;1-14-18(16-5-9-25-15(2)19(16)23)20-26-10-13-29(20)21(27-14)28-11-7-22(8-12-28)6-3-4-17(22)24;1-14-17(15-4-3-9-27-18(15)22(23,24)25)19-28-10-13-31(19)20(29-14)30-11-7-21(8-12-30)6-2-5-16(21)26;1-13-16(14-4-8-25-18(24)17(14)22)19-26-9-12-29(19)20(27-13)28-10-6-21(7-11-28)5-2-3-15(21)23/h6,10-11,14,16,18H,2-5,7-9,12-13,26H2,1H3,(H,27,30);5,9-10,13,16H,3-4,6-8,11-12,24H2,1-2H3,(H,25,26);5,9-10,13,17H,3-4,6-8,11-12,24H2,1-2H3;3-4,9-10,13,16H,2,5-8,11-12,26H2,1H3;4,8-9,12,15H,2-3,5-7,10-11,23H2,1H3,(H2,24,25)/t18-;16-;17-;16-;15-/m11111/s1.

What are the key properties of (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine?

(4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine has a molecular weight of 2131.35 g/mol, XLogP of 20.13, 13 rotatable bonds, 8 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for (4R)-8-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(cyclopropylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[3-chloro-2-(methylamino)-4-pyridinyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(3-chloro-2-methyl-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine;(4R)-8-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 165095701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).