sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride

C125H234B2Cl10F8N67NaO14S — CID 158156482

About sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride

sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride (PubChem CID 158156482) has the molecular formula C125H234B2Cl10F8N67NaO14S and a molecular weight of 3482.90 g/mol. Its IUPAC name is sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride.

Molecular Properties

• Compound Name: sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride
• PubChem CID: 158156482
• Molecular Formula: C125H234B2Cl10F8N67NaO14S
• Molecular Weight: 3482.90 g/mol
• Exact Mass: 3476.62
• IUPAC Name: sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride
• SMILES: C#CCN.C#CCN.C#CCN.C#CCN.C#CCNc1nc(NCCC)nc(N(C)OC)n1.C#CCNc1nc(NCCC)nc(N(C)OC)n1.C=C(Cl)CNc1nc(NCCC)nc(N(C)OC)n1.C=C(Cl)CNc1nc(NCCC)nc(N(C)OC)n1.CCCN.CCCNc1nc(Cl)nc(Cl)n1.CCCNc1nc(Cl)nc(N(C)OC)n1.CCCNc1nc(N(C)OC)nc([N+](C)(C)C)n1.CCCNc1nc(N(C)OC)nc([N+](C)(C)C)n1.CCCNc1nc(NC(C)C)nc(N(C)OC)n1.CCCNc1nc(NC(C)C)nc(N(C)OC)n1.CN(C)C.CNOC.Cl.Clc1nc(Cl)nc(Cl)n1.FB(F)F.F[B-](F)(F)F.O=S(=O)(O)O.[Cl-].[F-].[Na+]
• InChI: InChI=1S/2C11H19ClN6O.2C11H23N6O.2C11H22N6O.2C11H18N6O.C8H14ClN5O.C6H8Cl2N4.C3Cl3N3.2C3H9N.4C3H5N.C2H7NO.BF4.BF3.2ClH.FH.Na.H2O4S/c2*1-5-6-13-9-15-10(14-7-8(2)12)17-11(16-9)18(3)19-4;2*1-7-8-12-9-13-10(16(2)18-6)15-11(14-9)17(3,4)5;2*1-6-7-12-9-14-10(13-8(2)3)16-11(15-9)17(4)18-5;2*1-5-7-12-9-14-10(13-8-6-2)16-11(15-9)17(3)18-4;1-4-5-10-7-11-6(9)12-8(13-7)14(2)15-3;1-2-3-9-6-11-4(7)10-5(8)12-6;4-1-7-2(5)9-3(6)8-1;1-4(2)3;5*1-2-3-4;1-3-4-2;2-1(3,4)5;2-1(3)4;;;;;1-5(2,3)4/h2*2,5-7H2,1,3-4H3,(H2,13,14,15,16,17);2*7-8H2,1-6H3,(H,12,13,14,15);2*8H,6-7H2,1-5H3,(H2,12,13,14,15,16);2*1H,6-8H2,2-4H3,(H2,12,13,14,15,16);4-5H2,1-3H3,(H,10,11,12,13);2-3H2,1H3,(H,9,10,11,12);;1-3H3;2-4H2,1H3;4*1H,3-4H2;3H,1-2H3;;;3*1H;;(H2,1,2,3,4)/q;;2*+1;;;;;;;;;;;;;;;-1;;;;;+1;/p-2
• InChIKey: FVTFGJMYDDPOBN-UHFFFAOYSA-L
• XLogP: 6.73
• TPSA: 959.28 Ų
• H-Bond Donors: 24
• H-Bond Acceptors: 77
• Rotatable Bonds: 66
• Heavy Atoms: 228
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3482.90
LogP ≤ 5	6.73
H-Bond Donors ≤ 5	24
H-Bond Acceptors ≤ 10	77

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride?

The IUPAC name of sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride (CID 158156482) is sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride.

What is the SMILES notation for sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride?

The canonical SMILES for sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride is C#CCN.C#CCN.C#CCN.C#CCN.C#CCNc1nc(NCCC)nc(N(C)OC)n1.C#CCNc1nc(NCCC)nc(N(C)OC)n1.C=C(Cl)CNc1nc(NCCC)nc(N(C)OC)n1.C=C(Cl)CNc1nc(NCCC)nc(N(C)OC)n1.CCCN.CCCNc1nc(Cl)nc(Cl)n1.CCCNc1nc(Cl)nc(N(C)OC)n1.CCCNc1nc(N(C)OC)nc([N+](C)(C)C)n1.CCCNc1nc(N(C)OC)nc([N+](C)(C)C)n1.CCCNc1nc(NC(C)C)nc(N(C)OC)n1.CCCNc1nc(NC(C)C)nc(N(C)OC)n1.CN(C)C.CNOC.Cl.Clc1nc(Cl)nc(Cl)n1.FB(F)F.F[B-](F)(F)F.O=S(=O)(O)O.[Cl-].[F-].[Na+].

What is the InChIKey of sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride?

The InChIKey is FVTFGJMYDDPOBN-UHFFFAOYSA-L. The full InChI is InChI=1S/2C11H19ClN6O.2C11H23N6O.2C11H22N6O.2C11H18N6O.C8H14ClN5O.C6H8Cl2N4.C3Cl3N3.2C3H9N.4C3H5N.C2H7NO.BF4.BF3.2ClH.FH.Na.H2O4S/c2*1-5-6-13-9-15-10(14-7-8(2)12)17-11(16-9)18(3)19-4;2*1-7-8-12-9-13-10(16(2)18-6)15-11(14-9)17(3,4)5;2*1-6-7-12-9-14-10(13-8(2)3)16-11(15-9)17(4)18-5;2*1-5-7-12-9-14-10(13-8-6-2)16-11(15-9)17(3)18-4;1-4-5-10-7-11-6(9)12-8(13-7)14(2)15-3;1-2-3-9-6-11-4(7)10-5(8)12-6;4-1-7-2(5)9-3(6)8-1;1-4(2)3;5*1-2-3-4;1-3-4-2;2-1(3,4)5;2-1(3)4;;;;;1-5(2,3)4/h2*2,5-7H2,1,3-4H3,(H2,13,14,15,16,17);2*7-8H2,1-6H3,(H,12,13,14,15);2*8H,6-7H2,1-5H3,(H2,12,13,14,15,16);2*1H,6-8H2,2-4H3,(H2,12,13,14,15,16);4-5H2,1-3H3,(H,10,11,12,13);2-3H2,1H3,(H,9,10,11,12);;1-3H3;2-4H2,1H3;4*1H,3-4H2;3H,1-2H3;;;3*1H;;(H2,1,2,3,4)/q;;2*+1;;;;;;;;;;;;;;;-1;;;;;+1;/p-2.

What are the key properties of sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride?

sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride has a molecular weight of 3482.90 g/mol, XLogP of 6.73, 66 rotatable bonds, 24 hydrogen bond donors, and 77 hydrogen bond acceptors.

Where does this data come from?

All data for sodium;6-chloro-2-N-methoxy-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine;bis(4-N-(2-chloroprop-2-enyl)-2-N-methoxy-2-N-methyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);4,6-dichloro-N-propyl-1,3,5-triazin-2-amine;N,N-dimethylmethanamine;N-methoxymethanamine;bis([4-[methoxy(methyl)amino]-6-(propylamino)-1,3,5-triazin-2-yl]-trimethylazanium);bis(2-N-methoxy-2-N-methyl-4-N-propan-2-yl-6-N-propyl-1,3,5-triazine-2,4,6-triamine);bis(2-N-methoxy-2-N-methyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine);propan-1-amine;tetrakis(prop-2-yn-1-amine);sulfuric acid;2,4,6-trichloro-1,3,5-triazine;trifluoroborane;chloride;fluoride;tetrafluoroborate;hydrochloride is sourced from PubChem (CID 158156482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).