9-(2,2-dimethylpropyl)-9H-fluorene;ethane

C20H26 — CID 145284479

IUPAC9-(2,2-dimethylpropyl)-9H-fluorene;ethane
SMILESCC.CC(C)(C)CC1c2ccccc2-c2ccccc21
InChIInChI=1S/C18H20.C2H6/c1-18(2,3)12-17-15-10-6-4-8-13(15)14-9-5-7-11-16(14)17;1-2/h4-11,17H,12H2,1-3H3;1-2H3
InChIKeyXCEJKEACXFIEGQ-UHFFFAOYSA-N
MW266.43 g/mol
LogP6.26
Rot. Bonds1

About 9-(2,2-dimethylpropyl)-9H-fluorene;ethane

9-(2,2-dimethylpropyl)-9H-fluorene;ethane (PubChem CID 145284479) has the molecular formula C20H26 and a molecular weight of 266.43 g/mol. Its IUPAC name is 9-(2,2-dimethylpropyl)-9H-fluorene;ethane.

Molecular Properties

Compound Name9-(2,2-dimethylpropyl)-9H-fluorene;ethane
PubChem CID145284479
Molecular FormulaC20H26
Molecular Weight266.43 g/mol
Exact Mass266.20
IUPAC Name9-(2,2-dimethylpropyl)-9H-fluorene;ethane
SMILESCC.CC(C)(C)CC1c2ccccc2-c2ccccc21
InChIInChI=1S/C18H20.C2H6/c1-18(2,3)12-17-15-10-6-4-8-13(15)14-9-5-7-11-16(14)17;1-2/h4-11,17H,12H2,1-3H3;1-2H3
InChIKeyXCEJKEACXFIEGQ-UHFFFAOYSA-N
XLogP6.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.43
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 9-(2,2-dimethylpropyl)-9H-fluorene;ethane 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 9-(2,2-dimethylpropyl)-9H-fluorene;ethane?
The IUPAC name of 9-(2,2-dimethylpropyl)-9H-fluorene;ethane (CID 145284479) is 9-(2,2-dimethylpropyl)-9H-fluorene;ethane.
What is the SMILES notation for 9-(2,2-dimethylpropyl)-9H-fluorene;ethane?
The canonical SMILES for 9-(2,2-dimethylpropyl)-9H-fluorene;ethane is CC.CC(C)(C)CC1c2ccccc2-c2ccccc21.
What is the InChIKey of 9-(2,2-dimethylpropyl)-9H-fluorene;ethane?
The InChIKey is XCEJKEACXFIEGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20.C2H6/c1-18(2,3)12-17-15-10-6-4-8-13(15)14-9-5-7-11-16(14)17;1-2/h4-11,17H,12H2,1-3H3;1-2H3.
What are the key properties of 9-(2,2-dimethylpropyl)-9H-fluorene;ethane?
9-(2,2-dimethylpropyl)-9H-fluorene;ethane has a molecular weight of 266.43 g/mol, XLogP of 6.26, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,2-dimethylpropyl)-9H-fluorene;ethane is sourced from PubChem (CID 145284479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).