ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine

C22H27N3 — CID 165000125

IUPACethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine
SMILESCC.CC.Cc1nc(C)nc(-c2cccc3c2-c2ccccc2C3)n1
InChIInChI=1S/C18H15N3.2C2H6/c1-11-19-12(2)21-18(20-11)16-9-5-7-14-10-13-6-3-4-8-15(13)17(14)16;2*1-2/h3-9H,10H2,1-2H3;2*1-2H3
InChIKeyIDDPUDIVXVQVFU-UHFFFAOYSA-N
MW333.48 g/mol
LogP5.78
Rot. Bonds1

About ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine

ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine (PubChem CID 165000125) has the molecular formula C22H27N3 and a molecular weight of 333.48 g/mol. Its IUPAC name is ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine.

Molecular Properties

Compound Nameethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine
PubChem CID165000125
Molecular FormulaC22H27N3
Molecular Weight333.48 g/mol
Exact Mass333.22
IUPAC Nameethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine
SMILESCC.CC.Cc1nc(C)nc(-c2cccc3c2-c2ccccc2C3)n1
InChIInChI=1S/C18H15N3.2C2H6/c1-11-19-12(2)21-18(20-11)16-9-5-7-14-10-13-6-3-4-8-15(13)17(14)16;2*1-2/h3-9H,10H2,1-2H3;2*1-2H3
InChIKeyIDDPUDIVXVQVFU-UHFFFAOYSA-N
XLogP5.78
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.48
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine with MolForge

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Related Compounds

9H-fluoren-4-ylboronic acid
CID 68786516
2-[2-(9H-fluoren-4-yl)-6-methylphenoxy]ethanol
CID 151946123
2-(12,12-dimethyl-7H-indeno[1,2-a]fluoren-4-yl)-4,6-dinaphthalen-1-yl-1,3,5-triazine
CID 138646355
4,5-dimethyl-9H-fluorene
CID 14389533
4-(2,3,4-trifluorophenyl)-9H-fluorene
CID 174548890
2-cyclohepta-1,3,6-trien-1-yl-4-(9H-fluoren-4-yl)-6-phenyl-1,3,5-triazine
CID 167223526
ethene;9H-fluorene
CID 159544077
2-(5-bromo-9H-fluoren-4-yl)-4,6-diphenyl-1,3,5-triazine
CID 147440229
ethane;9H-fluorene;naphthalene;toluene
CID 160674058
4-(phenoxymethyl)-9H-fluorene
CID 3414387
bis(7,12-dihydroindeno[1,2-a]fluorene);bis(11,12-dihydroindeno[2,1-a]fluorene);bis(10,12-dihydroindeno[2,1-b]fluorene);ethane
CID 160769436
2-[2-(9H-fluoren-4-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine
CID 146886116

Frequently Asked Questions

What is the IUPAC name of ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine?
The IUPAC name of ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine (CID 165000125) is ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine.
What is the SMILES notation for ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine?
The canonical SMILES for ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine is CC.CC.Cc1nc(C)nc(-c2cccc3c2-c2ccccc2C3)n1.
What is the InChIKey of ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine?
The InChIKey is IDDPUDIVXVQVFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3.2C2H6/c1-11-19-12(2)21-18(20-11)16-9-5-7-14-10-13-6-3-4-8-15(13)17(14)16;2*1-2/h3-9H,10H2,1-2H3;2*1-2H3.
What are the key properties of ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine?
ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine has a molecular weight of 333.48 g/mol, XLogP of 5.78, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(9H-fluoren-4-yl)-4,6-dimethyl-1,3,5-triazine is sourced from PubChem (CID 165000125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).