2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine

C25H21N3 — CID 168805901

IUPAC2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine
SMILESCc1nc(-c2ccccc2)nc(-c2ccc3c(c2)-c2ccccc2C3(C)C)n1
InChIInChI=1S/C25H21N3/c1-16-26-23(17-9-5-4-6-10-17)28-24(27-16)18-13-14-22-20(15-18)19-11-7-8-12-21(19)25(22,2)3/h4-15H,1-3H3
InChIKeyWSIXSBLAOIJUCP-UHFFFAOYSA-N
MW363.46 g/mol
LogP5.82
Rot. Bonds2

About 2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine

2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine (PubChem CID 168805901) has the molecular formula C25H21N3 and a molecular weight of 363.46 g/mol. Its IUPAC name is 2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine
PubChem CID168805901
Molecular FormulaC25H21N3
Molecular Weight363.46 g/mol
Exact Mass363.17
IUPAC Name2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine
SMILESCc1nc(-c2ccccc2)nc(-c2ccc3c(c2)-c2ccccc2C3(C)C)n1
InChIInChI=1S/C25H21N3/c1-16-26-23(17-9-5-4-6-10-17)28-24(27-16)18-13-14-22-20(15-18)19-11-7-8-12-21(19)25(22,2)3/h4-15H,1-3H3
InChIKeyWSIXSBLAOIJUCP-UHFFFAOYSA-N
XLogP5.82
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.46
LogP ≤ 55.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazine;2,4-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazine;2,4-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2,4-bis[3-(9,9-dimethylfluoren-3-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 158233216
bis(2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine);2-[3-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 161026217
2-[3-[4-(9,9-dimethylfluoren-3-yl)-2-phenylphenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 174327334
2,4-bis(9,9-dimethylfluoren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 59188587
2-(9,9-dimethylfluoren-2-yl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 58233424
2-(9,9-dimethylfluoren-2-yl)-4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 162196088
2-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-3'-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 142504402
2-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-3'-yl)phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 146494836
2-(9,9-dimethylfluoren-3-yl)-4-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenyl-1,3,5-triazine
CID 165150998
2-(9,9-dimethylfluoren-3-yl)-4-[3-[3-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazine
CID 154613773
2-(4-methylphenyl)-4-phenyl-6-(9,9'-spirobi[fluorene]-3-yl)-1,3,5-triazine
CID 171844757
2-[3-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-3'-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 166995942

Frequently Asked Questions

What is the IUPAC name of 2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine?
The IUPAC name of 2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine (CID 168805901) is 2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine.
What is the SMILES notation for 2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine?
The canonical SMILES for 2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine is Cc1nc(-c2ccccc2)nc(-c2ccc3c(c2)-c2ccccc2C3(C)C)n1.
What is the InChIKey of 2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine?
The InChIKey is WSIXSBLAOIJUCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N3/c1-16-26-23(17-9-5-4-6-10-17)28-24(27-16)18-13-14-22-20(15-18)19-11-7-8-12-21(19)25(22,2)3/h4-15H,1-3H3.
What are the key properties of 2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine?
2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine has a molecular weight of 363.46 g/mol, XLogP of 5.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9,9-dimethylfluoren-3-yl)-4-methyl-6-phenyl-1,3,5-triazine is sourced from PubChem (CID 168805901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).