2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine

C110H160N60S5 — CID 157128087

IUPAC2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine
SMILESCC1=C(CN(C)c2nc(N)nc(N)n2)C=CC1.CC1=C(CNc2nc(N)nc(N(C)C)n2)C=CC1.CC1=C(CNc2nc(N)nc(N)n2)C=CC1.CC1=CC(CN(C)c2nc(N)nc(N)n2)=CC1.CC1=CC(CNc2nc(N)nc(N)n2)=CC1.CNc1nc(N)nc(N(C)Cc2ccc(C)s2)n1.CNc1nc(N)nc(NCc2ccc(C)s2)n1.CNc1nc(NC)nc(NCc2ccc(C)s2)n1.Cc1ccc(CNc2nc(N(C)C)nc(N(C)C)n2)s1.Cc1ccc(CNc2nc(N)nc(N(C)C)n2)s1
InChIInChI=1S/C13H20N6S.C12H18N6.3C11H16N6S.2C11H16N6.C10H14N6S.2C10H14N6/c1-9-6-7-10(20-9)8-14-11-15-12(18(2)3)17-13(16-11)19(4)5;1-8-5-4-6-9(8)7-14-11-15-10(13)16-12(17-11)18(2)3;1-7-4-5-8(18-7)6-13-10-14-9(12)15-11(16-10)17(2)3;1-7-4-5-8(18-7)6-17(3)11-15-9(12)14-10(13-2)16-11;1-7-4-5-8(18-7)6-14-11-16-9(12-2)15-10(13-3)17-11;1-7-3-4-8(5-7)6-17(2)11-15-9(12)14-10(13)16-11;1-7-4-3-5-8(7)6-17(2)11-15-9(12)14-10(13)16-11;1-6-3-4-7(17-6)5-13-10-15-8(11)14-9(12-2)16-10;1-6-2-3-7(4-6)5-13-10-15-8(11)14-9(12)16-10;1-6-3-2-4-7(6)5-13-10-15-8(11)14-9(12)16-10/h6-7H,8H2,1-5H3,(H,14,15,16,17);4,6H,5,7H2,1-3H3,(H3,13,14,15,16,17);2*4-5H,6H2,1-3H3,(H3,12,13,14,15,16);4-5H,6H2,1-3H3,(H3,12,13,14,15,16,17);4-5H,3,6H2,1-2H3,(H4,12,13,14,15,16);3,5H,4,6H2,1-2H3,(H4,12,13,14,15,16);3-4H,5H2,1-2H3,(H4,11,12,13,14,15,16);3-4H,2,5H2,1H3,(H5,11,12,13,14,15,16);2,4H,3,5H2,1H3,(H5,11,12,13,14,15,16)
InChIKeyAISVBTCCXQUDFF-UHFFFAOYSA-N
MW2483.24 g/mol
LogP12.56
Rot. Bonds38

About 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine

2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine (PubChem CID 157128087) has the molecular formula C110H160N60S5 and a molecular weight of 2483.24 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine
PubChem CID157128087
Molecular FormulaC110H160N60S5
Molecular Weight2483.24 g/mol
Exact Mass2481.30
IUPAC Name2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine
SMILESCC1=C(CN(C)c2nc(N)nc(N)n2)C=CC1.CC1=C(CNc2nc(N)nc(N(C)C)n2)C=CC1.CC1=C(CNc2nc(N)nc(N)n2)C=CC1.CC1=CC(CN(C)c2nc(N)nc(N)n2)=CC1.CC1=CC(CNc2nc(N)nc(N)n2)=CC1.CNc1nc(N)nc(N(C)Cc2ccc(C)s2)n1.CNc1nc(N)nc(NCc2ccc(C)s2)n1.CNc1nc(NC)nc(NCc2ccc(C)s2)n1.Cc1ccc(CNc2nc(N(C)C)nc(N(C)C)n2)s1.Cc1ccc(CNc2nc(N)nc(N(C)C)n2)s1
InChIInChI=1S/C13H20N6S.C12H18N6.3C11H16N6S.2C11H16N6.C10H14N6S.2C10H14N6/c1-9-6-7-10(20-9)8-14-11-15-12(18(2)3)17-13(16-11)19(4)5;1-8-5-4-6-9(8)7-14-11-15-10(13)16-12(17-11)18(2)3;1-7-4-5-8(18-7)6-13-10-14-9(12)15-11(16-10)17(2)3;1-7-4-5-8(18-7)6-17(3)11-15-9(12)14-10(13-2)16-11;1-7-4-5-8(18-7)6-14-11-16-9(12-2)15-10(13-3)17-11;1-7-3-4-8(5-7)6-17(2)11-15-9(12)14-10(13)16-11;1-7-4-3-5-8(7)6-17(2)11-15-9(12)14-10(13)16-11;1-6-3-4-7(17-6)5-13-10-15-8(11)14-9(12-2)16-10;1-6-2-3-7(4-6)5-13-10-15-8(11)14-9(12)16-10;1-6-3-2-4-7(6)5-13-10-15-8(11)14-9(12)16-10/h6-7H,8H2,1-5H3,(H,14,15,16,17);4,6H,5,7H2,1-3H3,(H3,13,14,15,16,17);2*4-5H,6H2,1-3H3,(H3,12,13,14,15,16);4-5H,6H2,1-3H3,(H3,12,13,14,15,16,17);4-5H,3,6H2,1-2H3,(H4,12,13,14,15,16);3,5H,4,6H2,1-2H3,(H4,12,13,14,15,16);3-4H,5H2,1-2H3,(H4,11,12,13,14,15,16);3-4H,2,5H2,1H3,(H5,11,12,13,14,15,16);2,4H,3,5H2,1H3,(H5,11,12,13,14,15,16)
InChIKeyAISVBTCCXQUDFF-UHFFFAOYSA-N
XLogP12.56
TPSA853.95 Ų
H-Bond Donors23
H-Bond Acceptors65
Rotatable Bonds38
Heavy Atoms175
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002483.24
LogP ≤ 512.56
H-Bond Donors ≤ 523
H-Bond Acceptors ≤ 1065

Analyze 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine (CID 157128087) is 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine is CC1=C(CN(C)c2nc(N)nc(N)n2)C=CC1.CC1=C(CNc2nc(N)nc(N(C)C)n2)C=CC1.CC1=C(CNc2nc(N)nc(N)n2)C=CC1.CC1=CC(CN(C)c2nc(N)nc(N)n2)=CC1.CC1=CC(CNc2nc(N)nc(N)n2)=CC1.CNc1nc(N)nc(N(C)Cc2ccc(C)s2)n1.CNc1nc(N)nc(NCc2ccc(C)s2)n1.CNc1nc(NC)nc(NCc2ccc(C)s2)n1.Cc1ccc(CNc2nc(N(C)C)nc(N(C)C)n2)s1.Cc1ccc(CNc2nc(N)nc(N(C)C)n2)s1.
What is the InChIKey of 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine?
The InChIKey is AISVBTCCXQUDFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6S.C12H18N6.3C11H16N6S.2C11H16N6.C10H14N6S.2C10H14N6/c1-9-6-7-10(20-9)8-14-11-15-12(18(2)3)17-13(16-11)19(4)5;1-8-5-4-6-9(8)7-14-11-15-10(13)16-12(17-11)18(2)3;1-7-4-5-8(18-7)6-13-10-14-9(12)15-11(16-10)17(2)3;1-7-4-5-8(18-7)6-17(3)11-15-9(12)14-10(13-2)16-11;1-7-4-5-8(18-7)6-14-11-16-9(12-2)15-10(13-3)17-11;1-7-3-4-8(5-7)6-17(2)11-15-9(12)14-10(13)16-11;1-7-4-3-5-8(7)6-17(2)11-15-9(12)14-10(13)16-11;1-6-3-4-7(17-6)5-13-10-15-8(11)14-9(12-2)16-10;1-6-2-3-7(4-6)5-13-10-15-8(11)14-9(12)16-10;1-6-3-2-4-7(6)5-13-10-15-8(11)14-9(12)16-10/h6-7H,8H2,1-5H3,(H,14,15,16,17);4,6H,5,7H2,1-3H3,(H3,13,14,15,16,17);2*4-5H,6H2,1-3H3,(H3,12,13,14,15,16);4-5H,6H2,1-3H3,(H3,12,13,14,15,16,17);4-5H,3,6H2,1-2H3,(H4,12,13,14,15,16);3,5H,4,6H2,1-2H3,(H4,12,13,14,15,16);3-4H,5H2,1-2H3,(H4,11,12,13,14,15,16);3-4H,2,5H2,1H3,(H5,11,12,13,14,15,16);2,4H,3,5H2,1H3,(H5,11,12,13,14,15,16).
What are the key properties of 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine?
2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine has a molecular weight of 2483.24 g/mol, XLogP of 12.56, 38 rotatable bonds, 23 hydrogen bond donors, and 65 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-4-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylthiophen-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 157128087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).