4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine

C94H89BrF3N25 — CID 158138659

IUPAC4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine
SMILESCCc1ccccc1Nc1nc(Nc2cccc(C)c2)nc(Nc2cccc(C)c2)n1.Cc1cccc(Nc2nc(Nc3ccc(Br)cc3)nc(Nc3cccc(C)c3)n2)c1.Cc1cccc(Nc2nc(Nc3cccc(C)c3)nc(Nc3cccc(C(F)(F)F)c3)n2)c1.Cc1cccc(Nc2nc(Nc3cccc(C)c3)nc(Nc3ccccn3)n2)c1
InChIInChI=1S/C25H26N6.C24H21F3N6.C23H21BrN6.C22H21N7/c1-4-19-11-5-6-14-22(19)28-25-30-23(26-20-12-7-9-17(2)15-20)29-24(31-25)27-21-13-8-10-18(3)16-21;1-15-6-3-9-18(12-15)28-21-31-22(29-19-10-4-7-16(2)13-19)33-23(32-21)30-20-11-5-8-17(14-20)24(25,26)27;1-15-5-3-7-19(13-15)26-22-28-21(25-18-11-9-17(24)10-12-18)29-23(30-22)27-20-8-4-6-16(2)14-20;1-15-7-5-9-17(13-15)24-20-27-21(25-18-10-6-8-16(2)14-18)29-22(28-20)26-19-11-3-4-12-23-19/h5-16H,4H2,1-3H3,(H3,26,27,28,29,30,31);3-14H,1-2H3,(H3,28,29,30,31,32,33);3-14H,1-2H3,(H3,25,26,27,28,29,30);3-14H,1-2H3,(H3,23,24,25,26,27,28,29)
InChIKeyFTRAEPYKADVPPH-UHFFFAOYSA-N
MW1705.82 g/mol
LogP24.62
Rot. Bonds25

About 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine

4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 158138659) has the molecular formula C94H89BrF3N25 and a molecular weight of 1705.82 g/mol. Its IUPAC name is 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine
PubChem CID158138659
Molecular FormulaC94H89BrF3N25
Molecular Weight1705.82 g/mol
Exact Mass1703.69
IUPAC Name4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine
SMILESCCc1ccccc1Nc1nc(Nc2cccc(C)c2)nc(Nc2cccc(C)c2)n1.Cc1cccc(Nc2nc(Nc3ccc(Br)cc3)nc(Nc3cccc(C)c3)n2)c1.Cc1cccc(Nc2nc(Nc3cccc(C)c3)nc(Nc3cccc(C(F)(F)F)c3)n2)c1.Cc1cccc(Nc2nc(Nc3cccc(C)c3)nc(Nc3ccccn3)n2)c1
InChIInChI=1S/C25H26N6.C24H21F3N6.C23H21BrN6.C22H21N7/c1-4-19-11-5-6-14-22(19)28-25-30-23(26-20-12-7-9-17(2)15-20)29-24(31-25)27-21-13-8-10-18(3)16-21;1-15-6-3-9-18(12-15)28-21-31-22(29-19-10-4-7-16(2)13-19)33-23(32-21)30-20-11-5-8-17(14-20)24(25,26)27;1-15-5-3-7-19(13-15)26-22-28-21(25-18-11-9-17(24)10-12-18)29-23(30-22)27-20-8-4-6-16(2)14-20;1-15-7-5-9-17(13-15)24-20-27-21(25-18-10-6-8-16(2)14-18)29-22(28-20)26-19-11-3-4-12-23-19/h5-16H,4H2,1-3H3,(H3,26,27,28,29,30,31);3-14H,1-2H3,(H3,28,29,30,31,32,33);3-14H,1-2H3,(H3,25,26,27,28,29,30);3-14H,1-2H3,(H3,23,24,25,26,27,28,29)
InChIKeyFTRAEPYKADVPPH-UHFFFAOYSA-N
XLogP24.62
TPSA311.93 Ų
H-Bond Donors12
H-Bond Acceptors25
Rotatable Bonds25
Heavy Atoms123
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001705.82
LogP ≤ 524.62
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1025

Analyze 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine with MolForge

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Related Compounds

6-N-[4-bromo-3-(trifluoromethyl)phenyl]-4-N,4-N-dimethyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine
CID 58863862
4-[2-(3,4-difluoroanilino)pyridin-4-yl]-N-(3,4-difluorophenyl)pyridin-2-amine;4-[2-[3-(trifluoromethyl)anilino]pyridin-4-yl]-N-[3-(trifluoromethyl)phenyl]pyridin-2-amine
CID 87930779
2-N-(4-bromophenyl)-4-N-(2-hexylphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141713322
2-N-(4-bromophenyl)-4-N-(2-pentylphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141713664
2-N-(4-bromophenyl)-4-N-(3-pentylphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141714137
2-N-(4-bromophenyl)-4-N-(2-ethylphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141714652
2-N-(4-bromophenyl)-4-N-(2-butylphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141714709
2-N-(4-bromophenyl)-4-N-(3-ethylphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141714712
2-N-(4-bromophenyl)-4-N-(2-propylphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141714806
2-N-(4-bromophenyl)-4-N-(3-propylphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141715427
2-N-(4-bromophenyl)-4-N-(3-hexylphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141715453
2-N-(4-bromophenyl)-4-N-(3-butylphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141715524

Frequently Asked Questions

What is the IUPAC name of 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine (CID 158138659) is 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine is CCc1ccccc1Nc1nc(Nc2cccc(C)c2)nc(Nc2cccc(C)c2)n1.Cc1cccc(Nc2nc(Nc3ccc(Br)cc3)nc(Nc3cccc(C)c3)n2)c1.Cc1cccc(Nc2nc(Nc3cccc(C)c3)nc(Nc3cccc(C(F)(F)F)c3)n2)c1.Cc1cccc(Nc2nc(Nc3cccc(C)c3)nc(Nc3ccccn3)n2)c1.
What is the InChIKey of 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is FTRAEPYKADVPPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N6.C24H21F3N6.C23H21BrN6.C22H21N7/c1-4-19-11-5-6-14-22(19)28-25-30-23(26-20-12-7-9-17(2)15-20)29-24(31-25)27-21-13-8-10-18(3)16-21;1-15-6-3-9-18(12-15)28-21-31-22(29-19-10-4-7-16(2)13-19)33-23(32-21)30-20-11-5-8-17(14-20)24(25,26)27;1-15-5-3-7-19(13-15)26-22-28-21(25-18-11-9-17(24)10-12-18)29-23(30-22)27-20-8-4-6-16(2)14-20;1-15-7-5-9-17(13-15)24-20-27-21(25-18-10-6-8-16(2)14-18)29-22(28-20)26-19-11-3-4-12-23-19/h5-16H,4H2,1-3H3,(H3,26,27,28,29,30,31);3-14H,1-2H3,(H3,28,29,30,31,32,33);3-14H,1-2H3,(H3,25,26,27,28,29,30);3-14H,1-2H3,(H3,23,24,25,26,27,28,29).
What are the key properties of 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine?
4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 1705.82 g/mol, XLogP of 24.62, 25 rotatable bonds, 12 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,6-N-bis(3-methylphenyl)-2-N-pyridin-2-yl-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-methylphenyl)-2-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine;6-N-(4-bromophenyl)-2-N,4-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-ethylphenyl)-4-N,6-N-bis(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 158138659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).