2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine

C16H12FN3 — CID 174842436

IUPAC2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine
SMILESCc1cc(-c2ncnc(-c3ccccc3)n2)ccc1F
InChIInChI=1S/C16H12FN3/c1-11-9-13(7-8-14(11)17)16-19-10-18-15(20-16)12-5-3-2-4-6-12/h2-10H,1H3
InChIKeyAFJIUKRSEDYINX-UHFFFAOYSA-N
MW265.29 g/mol
LogP3.65
Rot. Bonds2

About 2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine

2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine (PubChem CID 174842436) has the molecular formula C16H12FN3 and a molecular weight of 265.29 g/mol. Its IUPAC name is 2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine
PubChem CID174842436
Molecular FormulaC16H12FN3
Molecular Weight265.29 g/mol
Exact Mass265.10
IUPAC Name2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine
SMILESCc1cc(-c2ncnc(-c3ccccc3)n2)ccc1F
InChIInChI=1S/C16H12FN3/c1-11-9-13(7-8-14(11)17)16-19-10-18-15(20-16)12-5-3-2-4-6-12/h2-10H,1H3
InChIKeyAFJIUKRSEDYINX-UHFFFAOYSA-N
XLogP3.65
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methylphenyl)-4-phenyl-1,3,5-triazine
CID 134408534
2-(4-chlorophenyl)-4-(4-phenylphenyl)-1,3,5-triazine
CID 151473661
2-(3,4-dimethylphenyl)-4,6-diphenyl-1,3,5-triazine
CID 123624299
2-phenyl-4-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 134581962
2-(4-methylphenyl)-4-[4-[8-[4-[4-(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-2-yl]phenyl]-6-phenyl-1,3,5-triazine
CID 130440010
CID 158164242
CID 158164242
acetic acid;2,4-diphenyl-1,3,5-triazine;ethane
CID 91591144
2-phenyl-4-(4-pyridin-4-ylphenyl)-1,3,5-triazine
CID 149165836
2-phenyl-4-[4-(4-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine
CID 118583036
4,6-dichloro-2-(4-fluoro-3-methylphenyl)-5-methylpyrimidine
CID 63612311
4,6-dichloro-5-fluoro-2-(4-fluoro-3-methylphenyl)pyrimidine
CID 80550185
2-(4-fluoro-3-methylphenyl)pyrimidine-4-carbaldehyde
CID 62749320

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine?
The IUPAC name of 2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine (CID 174842436) is 2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine.
What is the SMILES notation for 2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine?
The canonical SMILES for 2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine is Cc1cc(-c2ncnc(-c3ccccc3)n2)ccc1F.
What is the InChIKey of 2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine?
The InChIKey is AFJIUKRSEDYINX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN3/c1-11-9-13(7-8-14(11)17)16-19-10-18-15(20-16)12-5-3-2-4-6-12/h2-10H,1H3.
What are the key properties of 2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine?
2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine has a molecular weight of 265.29 g/mol, XLogP of 3.65, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-3-methylphenyl)-4-phenyl-1,3,5-triazine is sourced from PubChem (CID 174842436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).