6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine)

C128H213N57O2S — CID 157266011

IUPAC6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine)
SMILESC/N=C1/N/C(=N\CCc2ccc(C)[nH]2)NC(C)N1.C/N=C1/NC(N(C)CCc2ccc(C)[nH]2)=NC(C)N1.CC1N=C(N(C)C)N(C)C(N(C)CCc2ccsc2)=N1.Cc1ccc(CC/N=C2/NC(N)=NC(C)N2)[nH]1.Cc1ccc(CC/N=C2/NC(N)=NC(C)N2)o1.Cc1ccc(CCN(C)C2=NC(C)N=C(N(C)C)N2)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N(C)C)N2)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N(C)C)N2C)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N)N2)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N)N2)o1
InChIInChI=1S/C15H26N6.2C14H24N6.C14H23N5S.C13H22N6.2C12H20N6.C12H19N5O.C11H18N6.C11H17N5O/c1-11-7-8-13(16-11)9-10-20(5)15-18-12(2)17-14(19(3)4)21(15)6;2*1-10-6-7-12(15-10)8-9-20(5)14-17-11(2)16-13(18-14)19(3)4;1-11-15-13(17(2)3)19(5)14(16-11)18(4)8-6-12-7-9-20-10-12;1-9-5-6-11(15-9)7-8-19(4)13-17-10(2)16-12(14-3)18-13;1-8-4-5-10(14-8)6-7-18(3)12-16-9(2)15-11(13)17-12;1-8-4-5-10(15-8)6-7-14-12-17-9(2)16-11(13-3)18-12;1-8-4-5-10(18-8)6-7-17(3)12-15-9(2)14-11(13)16-12;1-7-3-4-9(14-7)5-6-13-11-16-8(2)15-10(12)17-11;1-7-3-4-9(17-7)5-6-13-11-15-8(2)14-10(12)16-11/h7-8,12,16H,9-10H2,1-6H3;2*6-7,11,15H,8-9H2,1-5H3,(H,16,17,18);7,9-11H,6,8H2,1-5H3;5-6,10,15H,7-8H2,1-4H3,(H2,14,16,17,18);4-5,9,14H,6-7H2,1-3H3,(H3,13,15,16,17);4-5,9,15H,6-7H2,1-3H3,(H3,13,14,16,17,18);4-5,9H,6-7H2,1-3H3,(H3,13,14,15,16);3-4,8,14H,5-6H2,1-2H3,(H4,12,13,15,16,17);3-4,8H,5-6H2,1-2H3,(H4,12,13,14,15,16)
InChIKeyAXZSTRABWQDMII-UHFFFAOYSA-N
MW2614.58 g/mol
LogP7.72
Rot. Bonds30

About 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine)

6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine) (PubChem CID 157266011) has the molecular formula C128H213N57O2S and a molecular weight of 2614.58 g/mol. Its IUPAC name is 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine).

Molecular Properties

Compound Name6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine)
PubChem CID157266011
Molecular FormulaC128H213N57O2S
Molecular Weight2614.58 g/mol
Exact Mass2612.80
IUPAC Name6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine)
SMILESC/N=C1/N/C(=N\CCc2ccc(C)[nH]2)NC(C)N1.C/N=C1/NC(N(C)CCc2ccc(C)[nH]2)=NC(C)N1.CC1N=C(N(C)C)N(C)C(N(C)CCc2ccsc2)=N1.Cc1ccc(CC/N=C2/NC(N)=NC(C)N2)[nH]1.Cc1ccc(CC/N=C2/NC(N)=NC(C)N2)o1.Cc1ccc(CCN(C)C2=NC(C)N=C(N(C)C)N2)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N(C)C)N2)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N(C)C)N2C)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N)N2)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N)N2)o1
InChIInChI=1S/C15H26N6.2C14H24N6.C14H23N5S.C13H22N6.2C12H20N6.C12H19N5O.C11H18N6.C11H17N5O/c1-11-7-8-13(16-11)9-10-20(5)15-18-12(2)17-14(19(3)4)21(15)6;2*1-10-6-7-12(15-10)8-9-20(5)14-17-11(2)16-13(18-14)19(3)4;1-11-15-13(17(2)3)19(5)14(16-11)18(4)8-6-12-7-9-20-10-12;1-9-5-6-11(15-9)7-8-19(4)13-17-10(2)16-12(14-3)18-13;1-8-4-5-10(14-8)6-7-18(3)12-16-9(2)15-11(13)17-12;1-8-4-5-10(15-8)6-7-14-12-17-9(2)16-11(13-3)18-12;1-8-4-5-10(18-8)6-7-17(3)12-15-9(2)14-11(13)16-12;1-7-3-4-9(14-7)5-6-13-11-16-8(2)15-10(12)17-11;1-7-3-4-9(17-7)5-6-13-11-15-8(2)14-10(12)16-11/h7-8,12,16H,9-10H2,1-6H3;2*6-7,11,15H,8-9H2,1-5H3,(H,16,17,18);7,9-11H,6,8H2,1-5H3;5-6,10,15H,7-8H2,1-4H3,(H2,14,16,17,18);4-5,9,14H,6-7H2,1-3H3,(H3,13,15,16,17);4-5,9,15H,6-7H2,1-3H3,(H3,13,14,16,17,18);4-5,9H,6-7H2,1-3H3,(H3,13,14,15,16);3-4,8,14H,5-6H2,1-2H3,(H4,12,13,15,16,17);3-4,8H,5-6H2,1-2H3,(H4,12,13,14,15,16)
InChIKeyAXZSTRABWQDMII-UHFFFAOYSA-N
XLogP7.72
TPSA686.60 Ų
H-Bond Donors24
H-Bond Acceptors44
Rotatable Bonds30
Heavy Atoms188
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002614.58
LogP ≤ 57.72
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1044

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine) with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine)?
The IUPAC name of 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine) (CID 157266011) is 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine).
What is the SMILES notation for 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine)?
The canonical SMILES for 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine) is C/N=C1/N/C(=N\CCc2ccc(C)[nH]2)NC(C)N1.C/N=C1/NC(N(C)CCc2ccc(C)[nH]2)=NC(C)N1.CC1N=C(N(C)C)N(C)C(N(C)CCc2ccsc2)=N1.Cc1ccc(CC/N=C2/NC(N)=NC(C)N2)[nH]1.Cc1ccc(CC/N=C2/NC(N)=NC(C)N2)o1.Cc1ccc(CCN(C)C2=NC(C)N=C(N(C)C)N2)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N(C)C)N2)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N(C)C)N2C)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N)N2)[nH]1.Cc1ccc(CCN(C)C2=NC(C)N=C(N)N2)o1.
What is the InChIKey of 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine)?
The InChIKey is AXZSTRABWQDMII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N6.2C14H24N6.C14H23N5S.C13H22N6.2C12H20N6.C12H19N5O.C11H18N6.C11H17N5O/c1-11-7-8-13(16-11)9-10-20(5)15-18-12(2)17-14(19(3)4)21(15)6;2*1-10-6-7-12(15-10)8-9-20(5)14-17-11(2)16-13(18-14)19(3)4;1-11-15-13(17(2)3)19(5)14(16-11)18(4)8-6-12-7-9-20-10-12;1-9-5-6-11(15-9)7-8-19(4)13-17-10(2)16-12(14-3)18-13;1-8-4-5-10(14-8)6-7-18(3)12-16-9(2)15-11(13)17-12;1-8-4-5-10(15-8)6-7-14-12-17-9(2)16-11(13-3)18-12;1-8-4-5-10(18-8)6-7-17(3)12-15-9(2)14-11(13)16-12;1-7-3-4-9(14-7)5-6-13-11-16-8(2)15-10(12)17-11;1-7-3-4-9(17-7)5-6-13-11-15-8(2)14-10(12)16-11/h7-8,12,16H,9-10H2,1-6H3;2*6-7,11,15H,8-9H2,1-5H3,(H,16,17,18);7,9-11H,6,8H2,1-5H3;5-6,10,15H,7-8H2,1-4H3,(H2,14,16,17,18);4-5,9,14H,6-7H2,1-3H3,(H3,13,15,16,17);4-5,9,15H,6-7H2,1-3H3,(H3,13,14,16,17,18);4-5,9H,6-7H2,1-3H3,(H3,13,14,15,16);3-4,8,14H,5-6H2,1-2H3,(H4,12,13,15,16,17);3-4,8H,5-6H2,1-2H3,(H4,12,13,14,15,16).
What are the key properties of 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine)?
6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine) has a molecular weight of 2614.58 g/mol, XLogP of 7.72, 30 rotatable bonds, 24 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,4-dimethyl-6-N-[2-(5-methylfuran-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-6-methylimino-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[2-(5-methylfuran-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[2-(5-methyl-1H-pyrrol-2-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-2H-1,3,5-triazine-4,6-diamine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(2-thiophen-3-ylethyl)-2H-1,3,5-triazine-4,6-diamine;bis(2-N,2-N,6-N,4-tetramethyl-6-N-[2-(5-methyl-1H-pyrrol-2-yl)ethyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine) is sourced from PubChem (CID 157266011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).