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

C15H20N4O — CID 96668566

IUPAC4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine
SMILESCOc1cc(C)c(-c2nc(C)nc(N)n2)cc1C(C)C
InChIInChI=1S/C15H20N4O/c1-8(2)11-7-12(9(3)6-13(11)20-5)14-17-10(4)18-15(16)19-14/h6-8H,1-5H3,(H2,16,17,18,19)
InChIKeyODYXVWKROHBGSS-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.87
Rot. Bonds3

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

4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine (PubChem CID 96668566) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine
PubChem CID96668566
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine
SMILESCOc1cc(C)c(-c2nc(C)nc(N)n2)cc1C(C)C
InChIInChI=1S/C15H20N4O/c1-8(2)11-7-12(9(3)6-13(11)20-5)14-17-10(4)18-15(16)19-14/h6-8H,1-5H3,(H2,16,17,18,19)
InChIKeyODYXVWKROHBGSS-UHFFFAOYSA-N
XLogP2.87
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-methoxy-4,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-amine
CID 82478513
4-(5-chloro-4-ethoxy-2-methylphenyl)-6-methyl-1,3,5-triazin-2-amine
CID 98022071
4-(2-methoxy-4-methylphenyl)-6-methyl-1,3,5-triazin-2-amine
CID 106793544
5-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-3-methyl-1,2-oxazole
CID 116868925
[4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-2-yl]hydrazine
CID 39103679
[4-(4-methoxy-2,5-dimethylphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
CID 82483544
4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine
CID 116832495
[4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)thiophen-3-yl]methanamine
CID 98019630
2-(4-methoxy-2,5-dimethylphenyl)-6-methylpyrimidin-4-amine
CID 82293776
1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethylhydrazine
CID 82473084
(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine
CID 82296040
4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-2-amine
CID 82300017

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine (CID 96668566) is 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine is COc1cc(C)c(-c2nc(C)nc(N)n2)cc1C(C)C.
What is the InChIKey of 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine?
The InChIKey is ODYXVWKROHBGSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-8(2)11-7-12(9(3)6-13(11)20-5)14-17-10(4)18-15(16)19-14/h6-8H,1-5H3,(H2,16,17,18,19).
What are the key properties of 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine?
4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine has a molecular weight of 272.35 g/mol, XLogP of 2.87, 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-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 96668566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).