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

C13H16N4O — CID 82478513

IUPAC4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine
SMILESCOc1cc(C)c(C)cc1-c1nc(C)nc(N)n1
InChIInChI=1S/C13H16N4O/c1-7-5-10(11(18-4)6-8(7)2)12-15-9(3)16-13(14)17-12/h5-6H,1-4H3,(H2,14,15,16,17)
InChIKeyINRPMDFVZKCFME-UHFFFAOYSA-N
MW244.30 g/mol
LogP2.05
Rot. Bonds2

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

4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine (PubChem CID 82478513) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine
PubChem CID82478513
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine
SMILESCOc1cc(C)c(C)cc1-c1nc(C)nc(N)n1
InChIInChI=1S/C13H16N4O/c1-7-5-10(11(18-4)6-8(7)2)12-15-9(3)16-13(14)17-12/h5-6H,1-4H3,(H2,14,15,16,17)
InChIKeyINRPMDFVZKCFME-UHFFFAOYSA-N
XLogP2.05
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-methoxy-4-methylphenyl)-6-methyl-1,3,5-triazin-2-amine
CID 106793544
4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine
CID 96668566
2-(2-methoxy-4,5-dimethylphenyl)-6-methylpyrimidin-4-amine
CID 82293771
4-chloro-6-(2,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine
CID 83241667
4-(5-chloro-4-ethoxy-2-methylphenyl)-6-methyl-1,3,5-triazin-2-amine
CID 98022071
[4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
CID 82483544
2-(4-methoxy-2,5-dimethylphenyl)-6-methylpyrimidin-4-amine
CID 82293776
6-(5-chloro-2-methoxy-4-methylphenyl)-2-methylpyrimidin-4-amine
CID 82303503
2-(4-amino-6-methyl-1,3,5-triazin-2-yl)-5-methylbenzenethiol
CID 137199572
4-(5-chloro-2-methoxy-4-methylphenyl)-2,6-dimethylpyrimidin-5-amine
CID 98021439
4-(2-methoxy-4,5-dimethylphenyl)-2-methyl-1,3-thiazole
CID 82129096
4-(2-fluorophenyl)-6-methyl-1,3,5-triazin-2-amine
CID 82469916

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine (CID 82478513) is 4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine is COc1cc(C)c(C)cc1-c1nc(C)nc(N)n1.
What is the InChIKey of 4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine?
The InChIKey is INRPMDFVZKCFME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-7-5-10(11(18-4)6-8(7)2)12-15-9(3)16-13(14)17-12/h5-6H,1-4H3,(H2,14,15,16,17).
What are the key properties of 4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine?
4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine has a molecular weight of 244.30 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 82478513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).