potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide

C123H181Cl2F3KN27O21 — CID 161240525

About potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide

potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide (PubChem CID 161240525) has the molecular formula C123H181Cl2F3KN27O21 and a molecular weight of 2541.97 g/mol. Its IUPAC name is potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide.

Molecular Properties

• Compound Name: potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide
• PubChem CID: 161240525
• Molecular Formula: C123H181Cl2F3KN27O21
• Molecular Weight: 2541.97 g/mol
• Exact Mass: 2539.30
• IUPAC Name: potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide
• SMILES: C.C.CCCC[C@@H](N)C(=O)OC.CCCC[C@@H](Nc1nc(N)nc2cccnc12)C(=O)CCCO.CCCC[C@@H](Nc1nc(NCc2ccc(OC)cc2OC)nc2cccnc12)C(=O)CCCO.CCCC[C@@H](Nc1nc(NCc2ccc(OC)cc2OC)nc2cccnc12)C(=O)O.CCCC[C@@H](Nc1nc(NCc2ccc(OC)cc2OC)nc2cccnc12)C(=O)OC.CCN(C(C)C)C(C)C.COc1ccc(CN)c(OC)c1.Clc1nc(Cl)c2ncccc2n1.NCCO.O=CC(F)(F)F.[H][2H].[K+].[OH-]
• InChI: InChI=1S/C25H33N5O4.C23H29N5O4.C22H27N5O4.C16H23N5O2.C9H13NO2.C8H19N.C7H3Cl2N3.C7H15NO2.C2HF3O.C2H7NO.2CH4.K.H2O.H2/c1-4-5-8-19(21(32)10-7-14-31)28-24-23-20(9-6-13-26-23)29-25(30-24)27-16-17-11-12-18(33-2)15-22(17)34-3;1-5-6-8-18(22(29)32-4)26-21-20-17(9-7-12-24-20)27-23(28-21)25-14-15-10-11-16(30-2)13-19(15)31-3;1-4-5-7-17(21(28)29)25-20-19-16(8-6-11-23-19)26-22(27-20)24-13-14-9-10-15(30-2)12-18(14)31-3;1-2-3-6-11(13(23)8-5-10-22)19-15-14-12(7-4-9-18-14)20-16(17)21-15;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;1-3-4-5-6(8)7(9)10-2;3-2(4,5)1-6;3-1-2-4;;;;;/h6,9,11-13,15,19,31H,4-5,7-8,10,14,16H2,1-3H3,(H2,27,28,29,30);7,9-13,18H,5-6,8,14H2,1-4H3,(H2,25,26,27,28);6,8-12,17H,4-5,7,13H2,1-3H3,(H,28,29)(H2,24,25,26,27);4,7,9,11,22H,2-3,5-6,8,10H2,1H3,(H3,17,19,20,21);3-5H,6,10H2,1-2H3;7-8H,6H2,1-5H3;1-3H;6H,3-5,8H2,1-2H3;1H;4H,1-3H2;2*1H4;;1H2;1H/q;;;;;;;;;;;;+1;;/p-1/t19-;18-;17-;11-;;;;6-;;;;;;;/m1111...1......./s1/i;;;;;;;;;;;;;;1+1
• InChIKey: UZXZNXKILGUKEP-IMDKUJOGSA-M
• XLogP: 17.72
• TPSA: 690.52 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 47
• Rotatable Bonds: 56
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2541.97
LogP ≤ 5	17.72
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	47

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide?

The IUPAC name of potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide (CID 161240525) is potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide.

What is the SMILES notation for potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide?

The canonical SMILES for potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide is C.C.CCCC[C@@H](N)C(=O)OC.CCCC[C@@H](Nc1nc(N)nc2cccnc12)C(=O)CCCO.CCCC[C@@H](Nc1nc(NCc2ccc(OC)cc2OC)nc2cccnc12)C(=O)CCCO.CCCC[C@@H](Nc1nc(NCc2ccc(OC)cc2OC)nc2cccnc12)C(=O)O.CCCC[C@@H](Nc1nc(NCc2ccc(OC)cc2OC)nc2cccnc12)C(=O)OC.CCN(C(C)C)C(C)C.COc1ccc(CN)c(OC)c1.Clc1nc(Cl)c2ncccc2n1.NCCO.O=CC(F)(F)F.[H][2H].[K+].[OH-].

What is the InChIKey of potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide?

The InChIKey is UZXZNXKILGUKEP-IMDKUJOGSA-M. The full InChI is InChI=1S/C25H33N5O4.C23H29N5O4.C22H27N5O4.C16H23N5O2.C9H13NO2.C8H19N.C7H3Cl2N3.C7H15NO2.C2HF3O.C2H7NO.2CH4.K.H2O.H2/c1-4-5-8-19(21(32)10-7-14-31)28-24-23-20(9-6-13-26-23)29-25(30-24)27-16-17-11-12-18(33-2)15-22(17)34-3;1-5-6-8-18(22(29)32-4)26-21-20-17(9-7-12-24-20)27-23(28-21)25-14-15-10-11-16(30-2)13-19(15)31-3;1-4-5-7-17(21(28)29)25-20-19-16(8-6-11-23-19)26-22(27-20)24-13-14-9-10-15(30-2)12-18(14)31-3;1-2-3-6-11(13(23)8-5-10-22)19-15-14-12(7-4-9-18-14)20-16(17)21-15;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;1-3-4-5-6(8)7(9)10-2;3-2(4,5)1-6;3-1-2-4;;;;;/h6,9,11-13,15,19,31H,4-5,7-8,10,14,16H2,1-3H3,(H2,27,28,29,30);7,9-13,18H,5-6,8,14H2,1-4H3,(H2,25,26,27,28);6,8-12,17H,4-5,7,13H2,1-3H3,(H,28,29)(H2,24,25,26,27);4,7,9,11,22H,2-3,5-6,8,10H2,1H3,(H3,17,19,20,21);3-5H,6,10H2,1-2H3;7-8H,6H2,1-5H3;1-3H;6H,3-5,8H2,1-2H3;1H;4H,1-3H2;2*1H4;;1H2;1H/q;;;;;;;;;;;;+1;;/p-1/t19-;18-;17-;11-;;;;6-;;;;;;;/m1111...1......./s1/i;;;;;;;;;;;;;;1+1.

What are the key properties of potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide?

potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide has a molecular weight of 2541.97 g/mol, XLogP of 17.72, 56 rotatable bonds, 15 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;2-aminoethanol;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-1-hydroxynonan-4-one;deuterium monohydride;2,4-dichloropyrido[3,2-d]pyrimidine;(2,4-dimethoxyphenyl)methanamine;(2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoic acid;(5R)-5-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]-1-hydroxynonan-4-one;N-ethyl-N-propan-2-ylpropan-2-amine;methane;methyl (2R)-2-aminohexanoate;methyl (2R)-2-[[2-[(2,4-dimethoxyphenyl)methylamino]pyrido[3,2-d]pyrimidin-4-yl]amino]hexanoate;2,2,2-trifluoroacetaldehyde;hydroxide is sourced from PubChem (CID 161240525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).