dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde

C101H146Cl7F3K2N20O12 — CID 165071891

About dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde

dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde (PubChem CID 165071891) has the molecular formula C101H146Cl7F3K2N20O12 and a molecular weight of 2215.77 g/mol. Its IUPAC name is dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde.

Molecular Properties

• Compound Name: dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde
• PubChem CID: 165071891
• Molecular Formula: C101H146Cl7F3K2N20O12
• Molecular Weight: 2215.77 g/mol
• Exact Mass: 2210.85
• IUPAC Name: dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde
• SMILES: CCCCC[C@@](C)(N)CCC(C)=O.CCCCC[C@](C)(CCC(C)=O)Nc1nc(Cl)nc2cc(Cl)cnc12.CCCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cc(Cl)cnc12.CCCCC[C@](C)(CCC(C)=O)Nc1nc(NCc2ccc(OC)cc2OC)nc2cc(Cl)cnc12.CCN(C(C)C)C(C)C.COc1ccc(CN)c(OC)c1.Clc1cnc2c(Cl)nc(Cl)nc2c1.O=CC(F)(F)F.O=CO[O-].[H-].[K+].[K+]
• InChI: InChI=1S/C27H36ClN5O3.C18H24Cl2N4O.C18H26ClN5O.C11H23NO.C9H13NO2.C8H19N.C7H2Cl3N3.C2HF3O.CH2O3.2K.H/c1-6-7-8-12-27(3,13-11-18(2)34)33-25-24-22(14-20(28)17-29-24)31-26(32-25)30-16-19-9-10-21(35-4)15-23(19)36-5;2*1-4-5-6-8-18(3,9-7-12(2)25)24-16-15-14(22-17(20)23-16)10-13(19)11-21-15;1-4-5-6-8-11(3,12)9-7-10(2)13;1-11-8-4-3-7(6-10)9(5-8)12-2;1-6-9(7(2)3)8(4)5;8-3-1-4-5(11-2-3)6(9)13-7(10)12-4;3-2(4,5)1-6;2-1-4-3;;;/h9-10,14-15,17H,6-8,11-13,16H2,1-5H3,(H2,30,31,32,33);10-11H,4-9H2,1-3H3,(H,22,23,24);10-11H,4-9H2,1-3H3,(H3,20,22,23,24);4-9,12H2,1-3H3;3-5H,6,10H2,1-2H3;7-8H,6H2,1-5H3;1-2H;1H;1,3H;;;/q;;;;;;;;;2*+1;-1/p-1/t27-;2*18-;11-;;;;;;;;/m1111......../s1
• InChIKey: JXCIJBIDEZUSAC-WHBLFFBESA-M
• XLogP: 18.49
• TPSA: 455.73 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 32
• Rotatable Bonds: 46
• Heavy Atoms: 145
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2215.77
LogP ≤ 5	18.49
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde?

The IUPAC name of dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde (CID 165071891) is dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde.

What is the SMILES notation for dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde?

The canonical SMILES for dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde is CCCCC[C@@](C)(N)CCC(C)=O.CCCCC[C@](C)(CCC(C)=O)Nc1nc(Cl)nc2cc(Cl)cnc12.CCCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cc(Cl)cnc12.CCCCC[C@](C)(CCC(C)=O)Nc1nc(NCc2ccc(OC)cc2OC)nc2cc(Cl)cnc12.CCN(C(C)C)C(C)C.COc1ccc(CN)c(OC)c1.Clc1cnc2c(Cl)nc(Cl)nc2c1.O=CC(F)(F)F.O=CO[O-].[H-].[K+].[K+].

What is the InChIKey of dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde?

The InChIKey is JXCIJBIDEZUSAC-WHBLFFBESA-M. The full InChI is InChI=1S/C27H36ClN5O3.C18H24Cl2N4O.C18H26ClN5O.C11H23NO.C9H13NO2.C8H19N.C7H2Cl3N3.C2HF3O.CH2O3.2K.H/c1-6-7-8-12-27(3,13-11-18(2)34)33-25-24-22(14-20(28)17-29-24)31-26(32-25)30-16-19-9-10-21(35-4)15-23(19)36-5;2*1-4-5-6-8-18(3,9-7-12(2)25)24-16-15-14(22-17(20)23-16)10-13(19)11-21-15;1-4-5-6-8-11(3,12)9-7-10(2)13;1-11-8-4-3-7(6-10)9(5-8)12-2;1-6-9(7(2)3)8(4)5;8-3-1-4-5(11-2-3)6(9)13-7(10)12-4;3-2(4,5)1-6;2-1-4-3;;;/h9-10,14-15,17H,6-8,11-13,16H2,1-5H3,(H2,30,31,32,33);10-11H,4-9H2,1-3H3,(H,22,23,24);10-11H,4-9H2,1-3H3,(H3,20,22,23,24);4-9,12H2,1-3H3;3-5H,6,10H2,1-2H3;7-8H,6H2,1-5H3;1-2H;1H;1,3H;;;/q;;;;;;;;;2*+1;-1/p-1/t27-;2*18-;11-;;;;;;;;/m1111......../s1.

What are the key properties of dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde?

dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde has a molecular weight of 2215.77 g/mol, XLogP of 18.49, 46 rotatable bonds, 7 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;(5R)-5-[(2-amino-7-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[[7-chloro-2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;(5R)-5-[(2,7-dichloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(2,4-dimethoxyphenyl)methanamine;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate;2,4,7-trichloropyrido[3,2-d]pyrimidine;2,2,2-trifluoroacetaldehyde is sourced from PubChem (CID 165071891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).