2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine

C16H10F3N3 — CID 175345267

IUPAC2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine
SMILESFC(F)(F)c1ccc(-c2cccc(-c3ncncn3)c2)cc1
InChIInChI=1S/C16H10F3N3/c17-16(18,19)14-6-4-11(5-7-14)12-2-1-3-13(8-12)15-21-9-20-10-22-15/h1-10H
InChIKeyHQFFSYCTGAQKSJ-UHFFFAOYSA-N
MW301.27 g/mol
LogP4.22
Rot. Bonds2

About 2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine

2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine (PubChem CID 175345267) has the molecular formula C16H10F3N3 and a molecular weight of 301.27 g/mol. Its IUPAC name is 2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine.

Molecular Properties

Compound Name2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine
PubChem CID175345267
Molecular FormulaC16H10F3N3
Molecular Weight301.27 g/mol
Exact Mass301.08
IUPAC Name2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine
SMILESFC(F)(F)c1ccc(-c2cccc(-c3ncncn3)c2)cc1
InChIInChI=1S/C16H10F3N3/c17-16(18,19)14-6-4-11(5-7-14)12-2-1-3-13(8-12)15-21-9-20-10-22-15/h1-10H
InChIKeyHQFFSYCTGAQKSJ-UHFFFAOYSA-N
XLogP4.22
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.27
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(trifluoromethyl)phenyl]-1,3,5-triazine
CID 154214481
2-[4-(trifluoromethyl)phenyl]pyrimidine
CID 15486309
3,5-bis[4-(trifluoromethyl)phenyl]pyridine
CID 134623472
5-(4-tert-butylphenyl)-2-[3-(trifluoromethyl)phenyl]pyrimidine
CID 101484200
2-[3-(4-imidazol-1-ylphenyl)phenyl]-1,3,5-triazine
CID 141294128
N-pyrazin-1-ium-1-yl-3-[4-(trifluoromethyl)phenyl]benzamide
CID 166006262
2,4-bis(3-phenylphenyl)-1,3,5-triazine;2,4-dinaphthalen-2-yl-1,3,5-triazine;2,4-diphenyl-6-[3-(trifluoromethyl)phenyl]-1,3,5-triazine;2,4,6-triphenylpyrimidine;2,4,6-triphenyl-1,3,5-triazine
CID 161261724
4-[4-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]phenyl]pyridine
CID 169293640
1-methoxy-3-[4-(trifluoromethyl)phenyl]benzene
CID 14468002
4-[5-[3-(2,2,2-trifluoroethyl)phenyl]pyrimidin-2-yl]-5-[4-(trifluoromethyl)phenyl]pyrimidine
CID 173271107
2,4-bis[4-(trifluoromethyl)phenyl]pyridine
CID 134617794
5-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidine
CID 162568225

Frequently Asked Questions

What is the IUPAC name of 2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine?
The IUPAC name of 2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine (CID 175345267) is 2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine.
What is the SMILES notation for 2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine?
The canonical SMILES for 2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine is FC(F)(F)c1ccc(-c2cccc(-c3ncncn3)c2)cc1.
What is the InChIKey of 2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine?
The InChIKey is HQFFSYCTGAQKSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F3N3/c17-16(18,19)14-6-4-11(5-7-14)12-2-1-3-13(8-12)15-21-9-20-10-22-15/h1-10H.
What are the key properties of 2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine?
2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine has a molecular weight of 301.27 g/mol, XLogP of 4.22, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[4-(trifluoromethyl)phenyl]phenyl]-1,3,5-triazine is sourced from PubChem (CID 175345267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).