3-(2-ethylphenyl)-2,9,9-trimethylfluorene

C24H24 — CID 148907412

IUPAC3-(2-ethylphenyl)-2,9,9-trimethylfluorene
SMILESCCc1ccccc1-c1cc2c(cc1C)C(C)(C)c1ccccc1-2
InChIInChI=1S/C24H24/c1-5-17-10-6-7-11-18(17)20-15-21-19-12-8-9-13-22(19)24(3,4)23(21)14-16(20)2/h6-15H,5H2,1-4H3
InChIKeyPHYQDILWLXJGSC-UHFFFAOYSA-N
MW312.46 g/mol
LogP6.53
Rot. Bonds2

About 3-(2-ethylphenyl)-2,9,9-trimethylfluorene

3-(2-ethylphenyl)-2,9,9-trimethylfluorene (PubChem CID 148907412) has the molecular formula C24H24 and a molecular weight of 312.46 g/mol. Its IUPAC name is 3-(2-ethylphenyl)-2,9,9-trimethylfluorene.

Molecular Properties

Compound Name3-(2-ethylphenyl)-2,9,9-trimethylfluorene
PubChem CID148907412
Molecular FormulaC24H24
Molecular Weight312.46 g/mol
Exact Mass312.19
IUPAC Name3-(2-ethylphenyl)-2,9,9-trimethylfluorene
SMILESCCc1ccccc1-c1cc2c(cc1C)C(C)(C)c1ccccc1-2
InChIInChI=1S/C24H24/c1-5-17-10-6-7-11-18(17)20-15-21-19-12-8-9-13-22(19)24(3,4)23(21)14-16(20)2/h6-15H,5H2,1-4H3
InChIKeyPHYQDILWLXJGSC-UHFFFAOYSA-N
XLogP6.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.46
LogP ≤ 56.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 3-(2-ethylphenyl)-2,9,9-trimethylfluorene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylphenyl)-2,9,9-trimethylfluorene?
The IUPAC name of 3-(2-ethylphenyl)-2,9,9-trimethylfluorene (CID 148907412) is 3-(2-ethylphenyl)-2,9,9-trimethylfluorene.
What is the SMILES notation for 3-(2-ethylphenyl)-2,9,9-trimethylfluorene?
The canonical SMILES for 3-(2-ethylphenyl)-2,9,9-trimethylfluorene is CCc1ccccc1-c1cc2c(cc1C)C(C)(C)c1ccccc1-2.
What is the InChIKey of 3-(2-ethylphenyl)-2,9,9-trimethylfluorene?
The InChIKey is PHYQDILWLXJGSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24/c1-5-17-10-6-7-11-18(17)20-15-21-19-12-8-9-13-22(19)24(3,4)23(21)14-16(20)2/h6-15H,5H2,1-4H3.
What are the key properties of 3-(2-ethylphenyl)-2,9,9-trimethylfluorene?
3-(2-ethylphenyl)-2,9,9-trimethylfluorene has a molecular weight of 312.46 g/mol, XLogP of 6.53, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylphenyl)-2,9,9-trimethylfluorene is sourced from PubChem (CID 148907412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).