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

C12H14N4O — CID 82474358

IUPAC[4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
SMILESCOc1ccc(-c2nc(C)nc(CN)n2)cc1
InChIInChI=1S/C12H14N4O/c1-8-14-11(7-13)16-12(15-8)9-3-5-10(17-2)6-4-9/h3-6H,7,13H2,1-2H3
InChIKeyOGERCKWUZYQQDO-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.31
Rot. Bonds3

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

[4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine (PubChem CID 82474358) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is [4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine.

Molecular Properties

Compound Name[4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
PubChem CID82474358
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name[4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
SMILESCOc1ccc(-c2nc(C)nc(CN)n2)cc1
InChIInChI=1S/C12H14N4O/c1-8-14-11(7-13)16-12(15-8)9-3-5-10(17-2)6-4-9/h3-6H,7,13H2,1-2H3
InChIKeyOGERCKWUZYQQDO-UHFFFAOYSA-N
XLogP1.31
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(3-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine
CID 82474357
2,4,6-tris[4-(4-methoxyphenyl)phenyl]-1,3,5-triazine
CID 20652062
N'-[2-(4-methoxyphenyl)-4,6-dimethylpyrimidin-5-yl]propane-1,3-diamine
CID 117212536
2-ethyl-4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazine
CID 171108749
4-(4-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine
CID 55250868
2,4,6-tris(4-methoxyphenyl)pyrimidine
CID 11784296
2-[4-(4-ethylsulfanylphenyl)-6-methyl-1,3,5-triazin-2-yl]ethanamine
CID 96669810
6-(methoxymethyl)-2-(4-methoxyphenyl)pyrimidin-4-amine
CID 62319679
1-methoxy-4-[2-(4-methylphenoxy)ethoxy]benzene
CID 2284217
[3-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-5-yl]methanamine;hydrochloride
CID 51051991
1-[2-(4-methoxyphenyl)-4,6-dimethylpyrimidin-5-yl]-N-methylmethanamine
CID 62744615
[6-methoxy-2-(4-methylphenyl)pyrimidin-4-yl]methanamine
CID 83864402

Frequently Asked Questions

What is the IUPAC name of [4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine?
The IUPAC name of [4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine (CID 82474358) is [4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine.
What is the SMILES notation for [4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine?
The canonical SMILES for [4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine is COc1ccc(-c2nc(C)nc(CN)n2)cc1.
What is the InChIKey of [4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine?
The InChIKey is OGERCKWUZYQQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-8-14-11(7-13)16-12(15-8)9-3-5-10(17-2)6-4-9/h3-6H,7,13H2,1-2H3.
What are the key properties of [4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine?
[4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine has a molecular weight of 230.27 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methoxyphenyl)-6-methyl-1,3,5-triazin-2-yl]methanamine is sourced from PubChem (CID 82474358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).