2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine

C18H15N3 — CID 142724944

IUPAC2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2cc(-c3ncncn3)ccc21
InChIInChI=1S/C18H15N3/c1-18(2)15-6-4-3-5-13(15)14-9-12(7-8-16(14)18)17-20-10-19-11-21-17/h3-11H,1-2H3
InChIKeyLPSDLCUJESVDAC-UHFFFAOYSA-N
MW273.34 g/mol
LogP3.84
Rot. Bonds1

About 2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine

2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine (PubChem CID 142724944) has the molecular formula C18H15N3 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine
PubChem CID142724944
Molecular FormulaC18H15N3
Molecular Weight273.34 g/mol
Exact Mass273.13
IUPAC Name2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2cc(-c3ncncn3)ccc21
InChIInChI=1S/C18H15N3/c1-18(2)15-6-4-3-5-13(15)14-9-12(7-8-16(14)18)17-20-10-19-11-21-17/h3-11H,1-2H3
InChIKeyLPSDLCUJESVDAC-UHFFFAOYSA-N
XLogP3.84
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine?
The IUPAC name of 2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine (CID 142724944) is 2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine.
What is the SMILES notation for 2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine?
The canonical SMILES for 2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine is CC1(C)c2ccccc2-c2cc(-c3ncncn3)ccc21.
What is the InChIKey of 2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine?
The InChIKey is LPSDLCUJESVDAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3/c1-18(2)15-6-4-3-5-13(15)14-9-12(7-8-16(14)18)17-20-10-19-11-21-17/h3-11H,1-2H3.
What are the key properties of 2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine?
2-(9,9-dimethylfluoren-3-yl)-1,3,5-triazine has a molecular weight of 273.34 g/mol, XLogP of 3.84, 1 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)-1,3,5-triazine is sourced from PubChem (CID 142724944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).