4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine

C16H14N4 — CID 63866847

IUPAC4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine
SMILESCc1cccc(-c2nc(N)nc(-c3ccccc3)n2)c1
InChIInChI=1S/C16H14N4/c1-11-6-5-9-13(10-11)15-18-14(19-16(17)20-15)12-7-3-2-4-8-12/h2-10H,1H3,(H2,17,18,19,20)
InChIKeyAKYLFDNMUFAIGH-UHFFFAOYSA-N
MW262.32 g/mol
LogP3.10
Rot. Bonds2

About 4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine

4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine (PubChem CID 63866847) has the molecular formula C16H14N4 and a molecular weight of 262.32 g/mol. Its IUPAC name is 4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine
PubChem CID63866847
Molecular FormulaC16H14N4
Molecular Weight262.32 g/mol
Exact Mass262.12
IUPAC Name4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine
SMILESCc1cccc(-c2nc(N)nc(-c3ccccc3)n2)c1
InChIInChI=1S/C16H14N4/c1-11-6-5-9-13(10-11)15-18-14(19-16(17)20-15)12-7-3-2-4-8-12/h2-10H,1H3,(H2,17,18,19,20)
InChIKeyAKYLFDNMUFAIGH-UHFFFAOYSA-N
XLogP3.10
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[4-[4,6-bis(3-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 20652059
2-[3-(3-methylphenyl)phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 129263613
2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine
CID 171058363
2-(3-methylphenyl)-4-phenyl-1,3,5-triazine
CID 134408534
2-(4-methylphenyl)-4,6-diphenylpyrimidine;2-(3-methylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4-phenyl-6-(4-phenylphenyl)pyrimidine;2-(4-methylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 162112872
4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-amine
CID 22352251
2-[3-(3-methylphenyl)phenyl]-4,6-diphenylpyrimidine
CID 121315996
ethane;4-(3-methylphenyl)-2,6-diphenylpyrimidine
CID 144569166
4,6-bis(3-methylphenyl)pyrimidin-2-amine
CID 75360131
2-(4-methylphenyl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 129023213
4,6-dimethyl-2-(3-methylphenyl)pyrimidine
CID 55264289
4-cyclohexyl-6-(3-methylphenyl)-1,3,5-triazin-2-amine
CID 63867917

Frequently Asked Questions

What is the IUPAC name of 4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine (CID 63866847) is 4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine is Cc1cccc(-c2nc(N)nc(-c3ccccc3)n2)c1.
What is the InChIKey of 4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine?
The InChIKey is AKYLFDNMUFAIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4/c1-11-6-5-9-13(10-11)15-18-14(19-16(17)20-15)12-7-3-2-4-8-12/h2-10H,1H3,(H2,17,18,19,20).
What are the key properties of 4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine?
4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine has a molecular weight of 262.32 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 63866847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).