2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine

C101H143N61OS8 — CID 158996320

IUPAC2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine
SMILESCc1cc(CN(C)c2nc(N)nc(N)n2)cs1.Cc1cc(CNc2nc(N)nc(N(C)C)n2)cs1.Cc1cocc1CNc1nc(N)nc(N(C)C)n1.Cc1cscc1CN(C)c1nc(N)nc(N)n1.Cc1cscc1CNc1nc(N)nc(N(C)C)n1.Cc1cscc1CNc1nc(N)nc(N)n1.Cc1sccc1CN(C)c1nc(N)nc(N)n1.Cc1sccc1CNc1nc(N)nc(N(C)C)n1.Cc1sccc1CNc1nc(N)nc(N)n1.Nc1nc(N)nc(NCCc2ccc[nH]2)n1
InChIInChI=1S/C11H16N6O.3C11H16N6S.3C10H14N6S.C9H13N7.2C9H12N6S/c2*1-7-5-18-6-8(7)4-13-10-14-9(12)15-11(16-10)17(2)3;1-7-4-8(6-18-7)5-13-10-14-9(12)15-11(16-10)17(2)3;1-7-8(4-5-18-7)6-13-10-14-9(12)15-11(16-10)17(2)3;1-6-4-17-5-7(6)3-16(2)10-14-8(11)13-9(12)15-10;1-6-3-7(5-17-6)4-16(2)10-14-8(11)13-9(12)15-10;1-6-7(3-4-17-6)5-16(2)10-14-8(11)13-9(12)15-10;10-7-14-8(11)16-9(15-7)13-5-3-6-2-1-4-12-6;1-5-3-16-4-6(5)2-12-9-14-7(10)13-8(11)15-9;1-5-6(2-3-16-5)4-12-9-14-7(10)13-8(11)15-9/h2*5-6H,4H2,1-3H3,(H3,12,13,14,15,16);4,6H,5H2,1-3H3,(H3,12,13,14,15,16);4-5H,6H2,1-3H3,(H3,12,13,14,15,16);4-5H,3H2,1-2H3,(H4,11,12,13,14,15);3,5H,4H2,1-2H3,(H4,11,12,13,14,15);3-4H,5H2,1-2H3,(H4,11,12,13,14,15);1-2,4,12H,3,5H2,(H5,10,11,13,14,15,16);3-4H,2H2,1H3,(H5,10,11,12,13,14,15);2-3H,4H2,1H3,(H5,10,11,12,13,14,15)
InChIKeyJQTYXWYJWCWRIZ-UHFFFAOYSA-N
MW2484.22 g/mol
LogP10.72
Rot. Bonds35

About 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine

2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine (PubChem CID 158996320) has the molecular formula C101H143N61OS8 and a molecular weight of 2484.22 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine
PubChem CID158996320
Molecular FormulaC101H143N61OS8
Molecular Weight2484.22 g/mol
Exact Mass2482.08
IUPAC Name2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine
SMILESCc1cc(CN(C)c2nc(N)nc(N)n2)cs1.Cc1cc(CNc2nc(N)nc(N(C)C)n2)cs1.Cc1cocc1CNc1nc(N)nc(N(C)C)n1.Cc1cscc1CN(C)c1nc(N)nc(N)n1.Cc1cscc1CNc1nc(N)nc(N(C)C)n1.Cc1cscc1CNc1nc(N)nc(N)n1.Cc1sccc1CN(C)c1nc(N)nc(N)n1.Cc1sccc1CNc1nc(N)nc(N(C)C)n1.Cc1sccc1CNc1nc(N)nc(N)n1.Nc1nc(N)nc(NCCc2ccc[nH]2)n1
InChIInChI=1S/C11H16N6O.3C11H16N6S.3C10H14N6S.C9H13N7.2C9H12N6S/c2*1-7-5-18-6-8(7)4-13-10-14-9(12)15-11(16-10)17(2)3;1-7-4-8(6-18-7)5-13-10-14-9(12)15-11(16-10)17(2)3;1-7-8(4-5-18-7)6-13-10-14-9(12)15-11(16-10)17(2)3;1-6-4-17-5-7(6)3-16(2)10-14-8(11)13-9(12)15-10;1-6-3-7(5-17-6)4-16(2)10-14-8(11)13-9(12)15-10;1-6-7(3-4-17-6)5-16(2)10-14-8(11)13-9(12)15-10;10-7-14-8(11)16-9(15-7)13-5-3-6-2-1-4-12-6;1-5-3-16-4-6(5)2-12-9-14-7(10)13-8(11)15-9;1-5-6(2-3-16-5)4-12-9-14-7(10)13-8(11)15-9/h2*5-6H,4H2,1-3H3,(H3,12,13,14,15,16);4,6H,5H2,1-3H3,(H3,12,13,14,15,16);4-5H,6H2,1-3H3,(H3,12,13,14,15,16);4-5H,3H2,1-2H3,(H4,11,12,13,14,15);3,5H,4H2,1-2H3,(H4,11,12,13,14,15);3-4H,5H2,1-2H3,(H4,11,12,13,14,15);1-2,4,12H,3,5H2,(H5,10,11,13,14,15,16);3-4H,2H2,1H3,(H5,10,11,12,13,14,15);2-3H,4H2,1H3,(H5,10,11,12,13,14,15)
InChIKeyJQTYXWYJWCWRIZ-UHFFFAOYSA-N
XLogP10.72
TPSA938.84 Ų
H-Bond Donors24
H-Bond Acceptors69
Rotatable Bonds35
Heavy Atoms171
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002484.22
LogP ≤ 510.72
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1069

Analyze 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine with MolForge

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Launch Full Analysis

Related Compounds

3-methylfuran;2-methylpyrazine;bis(3-methylpyridine);2-methylpyrimidine;1-methylpyrrole;3-methyl-1H-pyrrole;5-methyl-1,3-thiazole;2-methylthiophene
CID 157330566
2,5-dimethyl-1H-pyrrole;ethane;methylcyclohexane;2-methylfuran;4-methylmorpholine;4-methylpiperidine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;2-methylthiophene;3-methylthiophene;toluene
CID 157353944
cumene;2-propan-2-ylfuran;3-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-ylthiophene;3-propan-2-ylthiophene
CID 157482357
2-tert-butylfuran;3-tert-butylfuran;2-tert-butylpyrazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-1H-pyrrole;3-tert-butyl-1H-pyrrole;2-tert-butylthiophene;3-tert-butylthiophene;2-tert-butyl-1,3,5-triazine
CID 157621968
2-N,2-N-dimethyl-4-N-(thiophen-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-(thiophen-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-(thiophen-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(furan-3-ylmethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(furan-3-ylmethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-(furan-3-ylmethyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;6-N-(furan-3-ylmethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-(thiophen-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-(thiophen-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-(thiophen-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(thiophen-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine
CID 157627232
2-Methylfuran;3-methylfuran;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methylthiophene;3-methylthiophene;toluene
CID 157633645
CID 157820329
CID 157820329
CID 157988845
CID 157988845
Ethane;methylcyclohexane;1-methylcyclopenta-1,3-diene;2-methylfuran;4-methylmorpholine;4-methyl-1,2-oxazole;4-methylpiperidine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;2-methylthiophene;3-methylthiophene;toluene
CID 158095813
bis(2,3-dimethylfuran);bis(2,3-dimethylpyridine);bis(3,4-dimethylpyridine);bis(2,3-dimethyl-1H-pyrrole);3,4-dimethyl-1H-pyrrole;bis(2,3-dimethylthiophene)
CID 158240059
ethane;methylcyclohexane;2-methylfuran;4-methylmorpholine;4-methylpiperidine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;2-methyl-1H-pyrrole;2-methylthiophene;3-methylthiophene;toluene
CID 158271471
CID 158585924
CID 158585924

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine (CID 158996320) is 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine is Cc1cc(CN(C)c2nc(N)nc(N)n2)cs1.Cc1cc(CNc2nc(N)nc(N(C)C)n2)cs1.Cc1cocc1CNc1nc(N)nc(N(C)C)n1.Cc1cscc1CN(C)c1nc(N)nc(N)n1.Cc1cscc1CNc1nc(N)nc(N(C)C)n1.Cc1cscc1CNc1nc(N)nc(N)n1.Cc1sccc1CN(C)c1nc(N)nc(N)n1.Cc1sccc1CNc1nc(N)nc(N(C)C)n1.Cc1sccc1CNc1nc(N)nc(N)n1.Nc1nc(N)nc(NCCc2ccc[nH]2)n1.
What is the InChIKey of 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine?
The InChIKey is JQTYXWYJWCWRIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6O.3C11H16N6S.3C10H14N6S.C9H13N7.2C9H12N6S/c2*1-7-5-18-6-8(7)4-13-10-14-9(12)15-11(16-10)17(2)3;1-7-4-8(6-18-7)5-13-10-14-9(12)15-11(16-10)17(2)3;1-7-8(4-5-18-7)6-13-10-14-9(12)15-11(16-10)17(2)3;1-6-4-17-5-7(6)3-16(2)10-14-8(11)13-9(12)15-10;1-6-3-7(5-17-6)4-16(2)10-14-8(11)13-9(12)15-10;1-6-7(3-4-17-6)5-16(2)10-14-8(11)13-9(12)15-10;10-7-14-8(11)16-9(15-7)13-5-3-6-2-1-4-12-6;1-5-3-16-4-6(5)2-12-9-14-7(10)13-8(11)15-9;1-5-6(2-3-16-5)4-12-9-14-7(10)13-8(11)15-9/h2*5-6H,4H2,1-3H3,(H3,12,13,14,15,16);4,6H,5H2,1-3H3,(H3,12,13,14,15,16);4-5H,6H2,1-3H3,(H3,12,13,14,15,16);4-5H,3H2,1-2H3,(H4,11,12,13,14,15);3,5H,4H2,1-2H3,(H4,11,12,13,14,15);3-4H,5H2,1-2H3,(H4,11,12,13,14,15);1-2,4,12H,3,5H2,(H5,10,11,13,14,15,16);3-4H,2H2,1H3,(H5,10,11,12,13,14,15);2-3H,4H2,1H3,(H5,10,11,12,13,14,15).
What are the key properties of 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine?
2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine has a molecular weight of 2484.22 g/mol, XLogP of 10.72, 35 rotatable bonds, 24 hydrogen bond donors, and 69 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-4-N-[(4-methylfuran-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(2-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(4-methylthiophen-3-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[2-(1H-pyrrol-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 158996320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).