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

C99H149Cl3K2N20O11 — CID 157159261

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

dipotassium;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-[(2-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate (PubChem CID 157159261) has the molecular formula C99H149Cl3K2N20O11 and a molecular weight of 1979.96 g/mol. Its IUPAC name is dipotassium;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-[(2-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate.

Molecular Properties

• Compound Name: dipotassium;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-[(2-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate
• PubChem CID: 157159261
• Molecular Formula: C99H149Cl3K2N20O11
• Molecular Weight: 1979.96 g/mol
• Exact Mass: 1977.01
• IUPAC Name: dipotassium;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-[(2-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate
• SMILES: CCCCC[C@@](C)(N)CCC(C)=O.CCCCC[C@](C)(CCC(C)=O)Nc1nc(Cl)nc2cccnc12.CCCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cccnc12.CCCCC[C@](C)(CCC(C)=O)Nc1nc(NCc2ccc(OC)cc2OC)nc2cccnc12.CCN(C(C)C)C(C)C.COc1ccc(CN)c(OC)c1.Clc1nc(Cl)c2ncccc2n1.O=CO[O-].[H-].[K+].[K+]
• InChI: InChI=1S/C27H37N5O3.C18H25ClN4O.C18H27N5O.C11H23NO.C9H13NO2.C8H19N.C7H3Cl2N3.CH2O3.2K.H/c1-6-7-8-14-27(3,15-13-19(2)33)32-25-24-22(10-9-16-28-24)30-26(31-25)29-18-20-11-12-21(34-4)17-23(20)35-5;2*1-4-5-6-10-18(3,11-9-13(2)24)23-16-15-14(8-7-12-20-15)21-17(19)22-16;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;8-6-5-4(2-1-3-10-5)11-7(9)12-6;2-1-4-3;;;/h9-12,16-17H,6-8,13-15,18H2,1-5H3,(H2,29,30,31,32);7-8,12H,4-6,9-11H2,1-3H3,(H,21,22,23);7-8,12H,4-6,9-11H2,1-3H3,(H3,19,21,22,23);4-9,12H2,1-3H3;3-5H,6,10H2,1-2H3;7-8H,6H2,1-5H3;1-3H;1,3H;;;/q;;;;;;;;2*+1;-1/p-1/t27-;2*18-;11-;;;;;;;/m1111......./s1
• InChIKey: RTQRNMUXNGWKNG-XETGIYICSA-M
• XLogP: 15.13
• TPSA: 438.66 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 31
• Rotatable Bonds: 46
• Heavy Atoms: 135
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1979.96
LogP ≤ 5	15.13
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	31

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

The IUPAC name of dipotassium;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-[(2-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate (CID 157159261) is dipotassium;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-[(2-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate.

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

The canonical SMILES for dipotassium;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-[(2-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate is CCCCC[C@@](C)(N)CCC(C)=O.CCCCC[C@](C)(CCC(C)=O)Nc1nc(Cl)nc2cccnc12.CCCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cccnc12.CCCCC[C@](C)(CCC(C)=O)Nc1nc(NCc2ccc(OC)cc2OC)nc2cccnc12.CCN(C(C)C)C(C)C.COc1ccc(CN)c(OC)c1.Clc1nc(Cl)c2ncccc2n1.O=CO[O-].[H-].[K+].[K+].

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

The InChIKey is RTQRNMUXNGWKNG-XETGIYICSA-M. The full InChI is InChI=1S/C27H37N5O3.C18H25ClN4O.C18H27N5O.C11H23NO.C9H13NO2.C8H19N.C7H3Cl2N3.CH2O3.2K.H/c1-6-7-8-14-27(3,15-13-19(2)33)32-25-24-22(10-9-16-28-24)30-26(31-25)29-18-20-11-12-21(34-4)17-23(20)35-5;2*1-4-5-6-10-18(3,11-9-13(2)24)23-16-15-14(8-7-12-20-15)21-17(19)22-16;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;8-6-5-4(2-1-3-10-5)11-7(9)12-6;2-1-4-3;;;/h9-12,16-17H,6-8,13-15,18H2,1-5H3,(H2,29,30,31,32);7-8,12H,4-6,9-11H2,1-3H3,(H,21,22,23);7-8,12H,4-6,9-11H2,1-3H3,(H3,19,21,22,23);4-9,12H2,1-3H3;3-5H,6,10H2,1-2H3;7-8H,6H2,1-5H3;1-3H;1,3H;;;/q;;;;;;;;2*+1;-1/p-1/t27-;2*18-;11-;;;;;;;/m1111......./s1.

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

dipotassium;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-[(2-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate has a molecular weight of 1979.96 g/mol, XLogP of 15.13, 46 rotatable bonds, 7 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;(5R)-5-amino-5-methyldecan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;(5R)-5-[(2-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyldecan-2-one;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-5-methyldecan-2-one;N-ethyl-N-propan-2-ylpropan-2-amine;hydride;oxido formate is sourced from PubChem (CID 157159261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).