(4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine

C112H144Cl3N31S — CID 158375732

About (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine

(4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine (PubChem CID 158375732) has the molecular formula C112H144Cl3N31S and a molecular weight of 2063.03 g/mol. Its IUPAC name is (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine.

Molecular Properties

• Compound Name: (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine
• PubChem CID: 158375732
• Molecular Formula: C112H144Cl3N31S
• Molecular Weight: 2063.03 g/mol
• Exact Mass: 2060.10
• IUPAC Name: (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine
• SMILES: CN[C@@H]1CCCC12CCN(c1nc(C)c(-c3c(C)cnn3C)c3nccn13)CC2.CN[C@@H]1CCCC12CCN(c1nc(C)c(-c3cccc(Cl)c3Cl)c3nccn13)CC2.CN[C@@H]1CCCC12CCN(c1nc(C)c(-c3cnc4ccccn34)c3nccn13)CC2.CN[C@@H]1CCCC12CCN(c1nc(C)c(-c3cnn(C)c3C)c3nccn13)CC2.CN[C@@H]1CCCC12CCN(c1nc(C)c(-c3sccc3Cl)c3nccn13)CC2
• InChI: InChI=1S/C24H29N7.C23H27Cl2N5.2C22H31N7.C21H26ClN5S/c1-17-21(18-16-27-20-7-3-4-12-30(18)20)22-26-11-15-31(22)23(28-17)29-13-9-24(10-14-29)8-5-6-19(24)25-2;1-15-19(16-5-3-6-17(24)20(16)25)21-27-11-14-30(21)22(28-15)29-12-9-23(10-13-29)8-4-7-18(23)26-2;1-15-19(17-14-25-27(4)16(17)2)20-24-10-13-29(20)21(26-15)28-11-8-22(9-12-28)7-5-6-18(22)23-3;1-15-14-25-27(4)19(15)18-16(2)26-21(29-13-10-24-20(18)29)28-11-8-22(9-12-28)7-5-6-17(22)23-3;1-14-17(18-15(22)5-13-28-18)19-24-9-12-27(19)20(25-14)26-10-7-21(8-11-26)6-3-4-16(21)23-2/h3-4,7,11-12,15-16,19,25H,5-6,8-10,13-14H2,1-2H3;3,5-6,11,14,18,26H,4,7-10,12-13H2,1-2H3;10,13-14,18,23H,5-9,11-12H2,1-4H3;10,13-14,17,23H,5-9,11-12H2,1-4H3;5,9,12-13,16,23H,3-4,6-8,10-11H2,1-2H3/t19-;2*18-;17-;16-/m11111/s1
• InChIKey: GVDZWCVQXAUFOR-RPVKXAMPSA-N
• XLogP: 20.07
• TPSA: 280.24 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 32
• Rotatable Bonds: 15
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2063.03
LogP ≤ 5	20.07
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine?

The IUPAC name of (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine (CID 158375732) is (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine.

What is the SMILES notation for (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine?

The canonical SMILES for (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine is CN[C@@H]1CCCC12CCN(c1nc(C)c(-c3c(C)cnn3C)c3nccn13)CC2.CN[C@@H]1CCCC12CCN(c1nc(C)c(-c3cccc(Cl)c3Cl)c3nccn13)CC2.CN[C@@H]1CCCC12CCN(c1nc(C)c(-c3cnc4ccccn34)c3nccn13)CC2.CN[C@@H]1CCCC12CCN(c1nc(C)c(-c3cnn(C)c3C)c3nccn13)CC2.CN[C@@H]1CCCC12CCN(c1nc(C)c(-c3sccc3Cl)c3nccn13)CC2.

What is the InChIKey of (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine?

The InChIKey is GVDZWCVQXAUFOR-RPVKXAMPSA-N. The full InChI is InChI=1S/C24H29N7.C23H27Cl2N5.2C22H31N7.C21H26ClN5S/c1-17-21(18-16-27-20-7-3-4-12-30(18)20)22-26-11-15-31(22)23(28-17)29-13-9-24(10-14-29)8-5-6-19(24)25-2;1-15-19(16-5-3-6-17(24)20(16)25)21-27-11-14-30(21)22(28-15)29-12-9-23(10-13-29)8-4-7-18(23)26-2;1-15-19(17-14-25-27(4)16(17)2)20-24-10-13-29(20)21(26-15)28-11-8-22(9-12-28)7-5-6-18(22)23-3;1-15-14-25-27(4)19(15)18-16(2)26-21(29-13-10-24-20(18)29)28-11-8-22(9-12-28)7-5-6-17(22)23-3;1-14-17(18-15(22)5-13-28-18)19-24-9-12-27(19)20(25-14)26-10-7-21(8-11-26)6-3-4-16(21)23-2/h3-4,7,11-12,15-16,19,25H,5-6,8-10,13-14H2,1-2H3;3,5-6,11,14,18,26H,4,7-10,12-13H2,1-2H3;10,13-14,18,23H,5-9,11-12H2,1-4H3;10,13-14,17,23H,5-9,11-12H2,1-4H3;5,9,12-13,16,23H,3-4,6-8,10-11H2,1-2H3/t19-;2*18-;17-;16-/m11111/s1.

What are the key properties of (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine?

(4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine has a molecular weight of 2063.03 g/mol, XLogP of 20.07, 15 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for (4R)-8-[8-(3-chlorothiophen-2-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,4-dimethylpyrazol-5-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(1,5-dimethylpyrazol-4-yl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-(8-imidazo[1,2-a]pyridin-3-yl-7-methylimidazo[1,2-c]pyrimidin-5-yl)-N-methyl-8-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 158375732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).