4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine

C12H14N4O — CID 116781866

IUPAC4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine
SMILESCOC(c1ccccc1)c1nc(C)nc(N)n1
InChIInChI=1S/C12H14N4O/c1-8-14-11(16-12(13)15-8)10(17-2)9-6-4-3-5-7-9/h3-7,10H,1-2H3,(H2,13,14,15,16)
InChIKeyOOLFCIUACYUXAL-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.50
Rot. Bonds3

About 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine

4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine (PubChem CID 116781866) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine
PubChem CID116781866
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine
SMILESCOC(c1ccccc1)c1nc(C)nc(N)n1
InChIInChI=1S/C12H14N4O/c1-8-14-11(16-12(13)15-8)10(17-2)9-6-4-3-5-7-9/h3-7,10H,1-2H3,(H2,13,14,15,16)
InChIKeyOOLFCIUACYUXAL-UHFFFAOYSA-N
XLogP1.50
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 ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-amino-2-[methoxy(phenyl)methyl]-6-methylpyrimidine-5-carbonitrile
CID 116782061
5-bromo-2-[methoxy(phenyl)methyl]-6-propan-2-ylpyrimidin-4-amine
CID 116776857
5-bromo-2-[methoxy(phenyl)methyl]-6-propylpyrimidin-4-amine
CID 116776608
5-bromo-3-[methoxy(phenyl)methyl]-1,2,4-thiadiazole
CID 102618231
4-chloro-5-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidine
CID 116745810
N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine
CID 116775791
[3-[methoxy(phenyl)methyl]-1,2,4-oxadiazol-5-yl]methanamine
CID 66490997
6-benzhydryloxy-1,3,5-triazine-2,4-diamine
CID 71405341
4-tert-butyl-6-chloro-2-[methoxy(phenyl)methyl]pyrimidine
CID 116745724
5-[3-[methoxy(phenyl)methyl]-1,2,4-oxadiazol-5-yl]pyridin-3-amine
CID 116743692
4-(1-methoxybutyl)-6-methyl-1,3,5-triazin-2-amine
CID 116734001
ethyl 2-[methoxy(phenyl)methyl]-4-methylpyrimidine-5-carboxylate
CID 102972511

Frequently Asked Questions

What is the IUPAC name of 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine (CID 116781866) is 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine is COC(c1ccccc1)c1nc(C)nc(N)n1.
What is the InChIKey of 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine?
The InChIKey is OOLFCIUACYUXAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-8-14-11(16-12(13)15-8)10(17-2)9-6-4-3-5-7-9/h3-7,10H,1-2H3,(H2,13,14,15,16).
What are the key properties of 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine?
4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine has a molecular weight of 230.27 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 116781866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).