5-fluoro-1,3-dimethylfluoren-9-one

C15H11FO — CID 82579551

IUPAC5-fluoro-1,3-dimethylfluoren-9-one
SMILESCc1cc(C)c2c(c1)-c1c(F)cccc1C2=O
InChIInChI=1S/C15H11FO/c1-8-6-9(2)13-11(7-8)14-10(15(13)17)4-3-5-12(14)16/h3-7H,1-2H3
InChIKeyHSFUSQHBFRKZGZ-UHFFFAOYSA-N
MW226.25 g/mol
LogP3.65
Rot. Bonds

About 5-fluoro-1,3-dimethylfluoren-9-one

5-fluoro-1,3-dimethylfluoren-9-one (PubChem CID 82579551) has the molecular formula C15H11FO and a molecular weight of 226.25 g/mol. Its IUPAC name is 5-fluoro-1,3-dimethylfluoren-9-one.

Molecular Properties

Compound Name5-fluoro-1,3-dimethylfluoren-9-one
PubChem CID82579551
Molecular FormulaC15H11FO
Molecular Weight226.25 g/mol
Exact Mass226.08
IUPAC Name5-fluoro-1,3-dimethylfluoren-9-one
SMILESCc1cc(C)c2c(c1)-c1c(F)cccc1C2=O
InChIInChI=1S/C15H11FO/c1-8-6-9(2)13-11(7-8)14-10(15(13)17)4-3-5-12(14)16/h3-7H,1-2H3
InChIKeyHSFUSQHBFRKZGZ-UHFFFAOYSA-N
XLogP3.65
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-fluoro-1,3-dimethylfluoren-9-one 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 5-fluoro-1,3-dimethylfluoren-9-one?
The IUPAC name of 5-fluoro-1,3-dimethylfluoren-9-one (CID 82579551) is 5-fluoro-1,3-dimethylfluoren-9-one.
What is the SMILES notation for 5-fluoro-1,3-dimethylfluoren-9-one?
The canonical SMILES for 5-fluoro-1,3-dimethylfluoren-9-one is Cc1cc(C)c2c(c1)-c1c(F)cccc1C2=O.
What is the InChIKey of 5-fluoro-1,3-dimethylfluoren-9-one?
The InChIKey is HSFUSQHBFRKZGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FO/c1-8-6-9(2)13-11(7-8)14-10(15(13)17)4-3-5-12(14)16/h3-7H,1-2H3.
What are the key properties of 5-fluoro-1,3-dimethylfluoren-9-one?
5-fluoro-1,3-dimethylfluoren-9-one has a molecular weight of 226.25 g/mol, XLogP of 3.65, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1,3-dimethylfluoren-9-one is sourced from PubChem (CID 82579551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).