[4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine

C14H18N4O — CID 82483544

IUPAC[4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
SMILESCOc1cc(C)c(-c2nc(C)nc(CN)n2)cc1C
InChIInChI=1S/C14H18N4O/c1-8-6-12(19-4)9(2)5-11(8)14-17-10(3)16-13(7-15)18-14/h5-6H,7,15H2,1-4H3
InChIKeyURYCOHZTIKFBAY-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.93
Rot. Bonds3

About [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine

[4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine (PubChem CID 82483544) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine.

Molecular Properties

Compound Name[4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
PubChem CID82483544
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name[4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
SMILESCOc1cc(C)c(-c2nc(C)nc(CN)n2)cc1C
InChIInChI=1S/C14H18N4O/c1-8-6-12(19-4)9(2)5-11(8)14-17-10(3)16-13(7-15)18-14/h5-6H,7,15H2,1-4H3
InChIKeyURYCOHZTIKFBAY-UHFFFAOYSA-N
XLogP1.93
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine with MolForge

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Related Compounds

[4-(5-fluoro-2-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
CID 82480164
[4-(2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
CID 82473895
2-(4-methoxy-2,5-dimethylphenyl)-6-methylpyrimidin-4-amine
CID 82293776
4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine
CID 82478513
[4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
CID 82474358
[5-(4-methoxy-2,5-dimethylphenyl)-3-methyl-1,2-oxazol-4-yl]methanamine
CID 82479432
[4-(3-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
CID 82474357
4-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-1,3-thiazole
CID 116891772
4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine
CID 96668566
[3-(4-methoxy-2,5-dimethylphenyl)pyrazin-2-yl]methanamine
CID 82478065
[4-(4-methoxy-2,5-dimethylphenyl)-1,3-oxazol-5-yl]methanamine
CID 82128869
(4-methoxy-6-methyl-1,3,5-triazin-2-yl)methanamine
CID 15515077

Frequently Asked Questions

What is the IUPAC name of [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine?
The IUPAC name of [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine (CID 82483544) is [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine.
What is the SMILES notation for [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine?
The canonical SMILES for [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine is COc1cc(C)c(-c2nc(C)nc(CN)n2)cc1C.
What is the InChIKey of [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine?
The InChIKey is URYCOHZTIKFBAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-8-6-12(19-4)9(2)5-11(8)14-17-10(3)16-13(7-15)18-14/h5-6H,7,15H2,1-4H3.
What are the key properties of [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine?
[4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine has a molecular weight of 258.32 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine is sourced from PubChem (CID 82483544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).