2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine

C33H22N4 — CID 161248550

IUPAC2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccnc(-c4ccc5c(c4)Cc4ccccc4-5)c3)n2)cc1
InChIInChI=1S/C33H22N4/c1-3-9-22(10-4-1)31-35-32(23-11-5-2-6-12-23)37-33(36-31)26-17-18-34-30(21-26)25-15-16-29-27(20-25)19-24-13-7-8-14-28(24)29/h1-18,20-21H,19H2
InChIKeyVAYPYHJCUTXYFC-UHFFFAOYSA-N
MW474.57 g/mol
LogP7.51
Rot. Bonds4

About 2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine

2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 161248550) has the molecular formula C33H22N4 and a molecular weight of 474.57 g/mol. Its IUPAC name is 2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine
PubChem CID161248550
Molecular FormulaC33H22N4
Molecular Weight474.57 g/mol
Exact Mass474.18
IUPAC Name2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccnc(-c4ccc5c(c4)Cc4ccccc4-5)c3)n2)cc1
InChIInChI=1S/C33H22N4/c1-3-9-22(10-4-1)31-35-32(23-11-5-2-6-12-23)37-33(36-31)26-17-18-34-30(21-26)25-15-16-29-27(20-25)19-24-13-7-8-14-28(24)29/h1-18,20-21H,19H2
InChIKeyVAYPYHJCUTXYFC-UHFFFAOYSA-N
XLogP7.51
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.57
LogP ≤ 57.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(9H-fluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 158076538
2-[2-(9H-fluoren-4-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine
CID 146886116
4-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-pyridinyl]-5H-indeno[1,2-d]pyrimidine
CID 118243296
4-(9H-fluoren-2-yl)pyrimidin-2-amine
CID 54468261
2-[3-(15,15-dimethyl-5-pentacyclo[21.4.0.02,7.09,14.016,21]heptacosa-1(27),2(7),3,5,9,11,13,16,18,20,23,25-dodecaenyl)phenyl]-4-phenyl-6-(4-phenylnaphthalen-1-yl)-1,3,5-triazine
CID 166995663
2,4-diphenyl-6-[3-[3-(4-phenylphenyl)-9H-fluoren-1-yl]phenyl]-1,3,5-triazine
CID 118685413
2-[3-[6-(9,9-dimethylfluoren-2-yl)-9H-fluoren-3-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 121241565
2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]pyridin-4-amine
CID 118183672
5-(9H-fluoren-2-yl)-2-[5-(9H-fluoren-2-yl)-2-pyridinyl]pyridine
CID 86049037
4-(9H-fluoren-2-yl)-2-[[4-(9H-fluoren-2-yl)-1,3-thiazol-2-yl]methyl]-1,3-thiazole
CID 4058232
3-phenyl-9H-indeno[2,1-c]pyridine
CID 155626331
2-[3-(4-chloro-2-pyridinyl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 171832572

Frequently Asked Questions

What is the IUPAC name of 2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine (CID 161248550) is 2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccnc(-c4ccc5c(c4)Cc4ccccc4-5)c3)n2)cc1.
What is the InChIKey of 2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine?
The InChIKey is VAYPYHJCUTXYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H22N4/c1-3-9-22(10-4-1)31-35-32(23-11-5-2-6-12-23)37-33(36-31)26-17-18-34-30(21-26)25-15-16-29-27(20-25)19-24-13-7-8-14-28(24)29/h1-18,20-21H,19H2.
What are the key properties of 2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine?
2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine has a molecular weight of 474.57 g/mol, XLogP of 7.51, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(9H-fluoren-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 161248550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).