2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine

C21H19N7 — CID 67212949

IUPAC2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine
SMILESc1ccc(Nc2nc(NCc3ccccn3)nc(Nc3ccccc3)n2)cc1
InChIInChI=1S/C21H19N7/c1-3-9-16(10-4-1)24-20-26-19(23-15-18-13-7-8-14-22-18)27-21(28-20)25-17-11-5-2-6-12-17/h1-14H,15H2,(H3,23,24,25,26,27,28)
InChIKeyOALQARVHOSHDEP-UHFFFAOYSA-N
MW369.43 g/mol
LogP4.37
Rot. Bonds7

About 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine

2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 67212949) has the molecular formula C21H19N7 and a molecular weight of 369.43 g/mol. Its IUPAC name is 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine
PubChem CID67212949
Molecular FormulaC21H19N7
Molecular Weight369.43 g/mol
Exact Mass369.17
IUPAC Name2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine
SMILESc1ccc(Nc2nc(NCc3ccccn3)nc(Nc3ccccc3)n2)cc1
InChIInChI=1S/C21H19N7/c1-3-9-16(10-4-1)24-20-26-19(23-15-18-13-7-8-14-22-18)27-21(28-20)25-17-11-5-2-6-12-17/h1-14H,15H2,(H3,23,24,25,26,27,28)
InChIKeyOALQARVHOSHDEP-UHFFFAOYSA-N
XLogP4.37
TPSA87.65 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 54.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine with MolForge

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Related Compounds

6-methyl-2-N-phenyl-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112919143
4-(4-phenylphenyl)-N-(pyridin-2-ylmethyl)aniline
CID 101246794
6-methyl-2-N-(4-propan-2-ylphenyl)-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112919161
2-N-(4-bromophenyl)-6-methyl-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112919180
3-phenoxy-N-(pyridin-2-ylmethyl)aniline
CID 61369486
2-N-(4-ethylphenyl)-6-phenyl-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112937134
N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
CID 123270108
6-N-[5-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]pentyl]-2-N,4-N-diphenyl-1,3,5-triazine-2,4,6-triamine
CID 20775300
2-N-(3,5-dimethylphenyl)-6-phenyl-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112937130
2-N-[4-(dimethylamino)phenyl]-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112893245
3-N-(4-methylphenyl)-5-N-(pyridin-2-ylmethyl)-1,2,4-triazine-3,5-diamine
CID 112951894
4-N-(3-methylphenyl)-6-phenyl-2-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112937182

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine (CID 67212949) is 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine is c1ccc(Nc2nc(NCc3ccccn3)nc(Nc3ccccc3)n2)cc1.
What is the InChIKey of 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is OALQARVHOSHDEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N7/c1-3-9-16(10-4-1)24-20-26-19(23-15-18-13-7-8-14-22-18)27-21(28-20)25-17-11-5-2-6-12-17/h1-14H,15H2,(H3,23,24,25,26,27,28).
What are the key properties of 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine?
2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 369.43 g/mol, XLogP of 4.37, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 67212949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).