4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine

C19H20N4 — CID 155659770

IUPAC4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine
SMILESCc1cccc(-c2nc(N)nc(-c3cccc(C)c3C)n2)c1C
InChIInChI=1S/C19H20N4/c1-11-7-5-9-15(13(11)3)17-21-18(23-19(20)22-17)16-10-6-8-12(2)14(16)4/h5-10H,1-4H3,(H2,20,21,22,23)
InChIKeyGMHRWRPTBTZLBD-UHFFFAOYSA-N
MW304.40 g/mol
LogP4.02
Rot. Bonds2

About 4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine

4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine (PubChem CID 155659770) has the molecular formula C19H20N4 and a molecular weight of 304.40 g/mol. Its IUPAC name is 4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine
PubChem CID155659770
Molecular FormulaC19H20N4
Molecular Weight304.40 g/mol
Exact Mass304.17
IUPAC Name4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine
SMILESCc1cccc(-c2nc(N)nc(-c3cccc(C)c3C)n2)c1C
InChIInChI=1S/C19H20N4/c1-11-7-5-9-15(13(11)3)17-21-18(23-19(20)22-17)16-10-6-8-12(2)14(16)4/h5-10H,1-4H3,(H2,20,21,22,23)
InChIKeyGMHRWRPTBTZLBD-UHFFFAOYSA-N
XLogP4.02
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,4,6-tris(2,3-dimethylphenyl)-1,3,5-triazine
CID 22475994
6-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
CID 2730671
6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine
CID 112681364
3-(4,6-diamino-1,3,5-triazin-2-yl)-2-methylphenol
CID 112681318
4-chloro-6-(2-fluoro-3-methylphenyl)-1,3,5-triazin-2-amine
CID 83240116
[2-(2,3-dimethylphenyl)-5,6-dimethylpyrimidin-4-yl]hydrazine
CID 62250013
2-(2,3-dimethylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-amine
CID 106472866
4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-amine
CID 165048378
5-(2,3-dimethylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 155519426
4-(2-methylphenyl)-1,3,5-triazin-2-amine
CID 63868713
2-(2,3-dimethylphenyl)-6-(2-methylphenyl)pyridine
CID 123263739
5-[4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-yl]benzimidazolo[1,2-a]benzimidazole
CID 170295081

Frequently Asked Questions

What is the IUPAC name of 4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine (CID 155659770) is 4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine is Cc1cccc(-c2nc(N)nc(-c3cccc(C)c3C)n2)c1C.
What is the InChIKey of 4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine?
The InChIKey is GMHRWRPTBTZLBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4/c1-11-7-5-9-15(13(11)3)17-21-18(23-19(20)22-17)16-10-6-8-12(2)14(16)4/h5-10H,1-4H3,(H2,20,21,22,23).
What are the key properties of 4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine?
4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine has a molecular weight of 304.40 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 155659770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).