6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine

C76H117N35O7 — CID 162180199

IUPAC6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine
SMILESC/N=C1/NC(N(C)c2ccc(C)o2)=NC(C)N1.C/N=C1/NC(Nc2ccc(C)o2)=NC(C)N1.Cc1ccc(N(C)C2=NC(C)N=C(N(C)C)N2)o1.Cc1ccc(N(C)C2=NC(C)N=C(N(C)C)N2C)o1.Cc1ccc(N(C)C2=NC(C)N=C(N)N2)o1.Cc1ccc(NC2=NC(C)N=C(N(C)C)N2)o1.Cc1ccc(NC2=NC(C)N=C(N)N2)o1
InChIInChI=1S/C13H21N5O.C12H19N5O.2C11H17N5O.2C10H15N5O.C9H13N5O/c1-9-7-8-11(19-9)17(5)13-15-10(2)14-12(16(3)4)18(13)6;1-8-6-7-10(18-8)17(5)12-14-9(2)13-11(15-12)16(3)4;1-7-5-6-9(17-7)14-10-12-8(2)13-11(15-10)16(3)4;1-7-5-6-9(17-7)16(4)11-14-8(2)13-10(12-3)15-11;1-6-4-5-8(16-6)15(3)10-13-7(2)12-9(11)14-10;1-6-4-5-8(16-6)14-10-13-7(2)12-9(11-3)15-10;1-5-3-4-7(15-5)13-9-12-6(2)11-8(10)14-9/h7-8,10H,1-6H3;6-7,9H,1-5H3,(H,13,14,15);2*5-6,8H,1-4H3,(H2,12,13,14,15);4-5,7H,1-3H3,(H3,11,12,13,14);4-5,7H,1-3H3,(H3,11,12,13,14,15);3-4,6H,1-2H3,(H4,10,11,12,13,14)
InChIKeyZOXMFJDFAVHUDB-UHFFFAOYSA-N
MW1633.01 g/mol
LogP7.11
Rot. Bonds7

About 6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine

6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine (PubChem CID 162180199) has the molecular formula C76H117N35O7 and a molecular weight of 1633.01 g/mol. Its IUPAC name is 6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine.

Molecular Properties

Compound Name6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine
PubChem CID162180199
Molecular FormulaC76H117N35O7
Molecular Weight1633.01 g/mol
Exact Mass1631.99
IUPAC Name6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine
SMILESC/N=C1/NC(N(C)c2ccc(C)o2)=NC(C)N1.C/N=C1/NC(Nc2ccc(C)o2)=NC(C)N1.Cc1ccc(N(C)C2=NC(C)N=C(N(C)C)N2)o1.Cc1ccc(N(C)C2=NC(C)N=C(N(C)C)N2C)o1.Cc1ccc(N(C)C2=NC(C)N=C(N)N2)o1.Cc1ccc(NC2=NC(C)N=C(N(C)C)N2)o1.Cc1ccc(NC2=NC(C)N=C(N)N2)o1
InChIInChI=1S/C13H21N5O.C12H19N5O.2C11H17N5O.2C10H15N5O.C9H13N5O/c1-9-7-8-11(19-9)17(5)13-15-10(2)14-12(16(3)4)18(13)6;1-8-6-7-10(18-8)17(5)12-14-9(2)13-11(15-12)16(3)4;1-7-5-6-9(17-7)14-10-12-8(2)13-11(15-10)16(3)4;1-7-5-6-9(17-7)16(4)11-14-8(2)13-10(12-3)15-11;1-6-4-5-8(16-6)15(3)10-13-7(2)12-9(11)14-10;1-6-4-5-8(16-6)14-10-13-7(2)12-9(11-3)15-10;1-5-3-4-7(15-5)13-9-12-6(2)11-8(10)14-9/h7-8,10H,1-6H3;6-7,9H,1-5H3,(H,13,14,15);2*5-6,8H,1-4H3,(H2,12,13,14,15);4-5,7H,1-3H3,(H3,11,12,13,14);4-5,7H,1-3H3,(H3,11,12,13,14,15);3-4,6H,1-2H3,(H4,10,11,12,13,14)
InChIKeyZOXMFJDFAVHUDB-UHFFFAOYSA-N
XLogP7.11
TPSA475.31 Ų
H-Bond Donors13
H-Bond Acceptors38
Rotatable Bonds7
Heavy Atoms118
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001633.01
LogP ≤ 57.11
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

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

Analyze 6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-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-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The IUPAC name of 6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine (CID 162180199) is 6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine.
What is the SMILES notation for 6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The canonical SMILES for 6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine is C/N=C1/NC(N(C)c2ccc(C)o2)=NC(C)N1.C/N=C1/NC(Nc2ccc(C)o2)=NC(C)N1.Cc1ccc(N(C)C2=NC(C)N=C(N(C)C)N2)o1.Cc1ccc(N(C)C2=NC(C)N=C(N(C)C)N2C)o1.Cc1ccc(N(C)C2=NC(C)N=C(N)N2)o1.Cc1ccc(NC2=NC(C)N=C(N(C)C)N2)o1.Cc1ccc(NC2=NC(C)N=C(N)N2)o1.
What is the InChIKey of 6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The InChIKey is ZOXMFJDFAVHUDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O.C12H19N5O.2C11H17N5O.2C10H15N5O.C9H13N5O/c1-9-7-8-11(19-9)17(5)13-15-10(2)14-12(16(3)4)18(13)6;1-8-6-7-10(18-8)17(5)12-14-9(2)13-11(15-12)16(3)4;1-7-5-6-9(17-7)14-10-12-8(2)13-11(15-10)16(3)4;1-7-5-6-9(17-7)16(4)11-14-8(2)13-10(12-3)15-11;1-6-4-5-8(16-6)15(3)10-13-7(2)12-9(11)14-10;1-6-4-5-8(16-6)14-10-13-7(2)12-9(11-3)15-10;1-5-3-4-7(15-5)13-9-12-6(2)11-8(10)14-9/h7-8,10H,1-6H3;6-7,9H,1-5H3,(H,13,14,15);2*5-6,8H,1-4H3,(H2,12,13,14,15);4-5,7H,1-3H3,(H3,11,12,13,14);4-5,7H,1-3H3,(H3,11,12,13,14,15);3-4,6H,1-2H3,(H4,10,11,12,13,14).
What are the key properties of 6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine?
6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine has a molecular weight of 1633.01 g/mol, XLogP of 7.11, 7 rotatable bonds, 13 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,4-dimethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,2-dimethyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-methyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-methyl-N-(5-methylfuran-2-yl)-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(5-methylfuran-2-yl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;6-N,6-N,4-trimethyl-2-N-(5-methylfuran-2-yl)-1,4-dihydro-1,3,5-triazine-2,6-diamine is sourced from PubChem (CID 162180199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).