4-aminofluoren-9-one

C13H9NO — CID 20267

IUPAC4-aminofluoren-9-one
SMILESNc1cccc2c1-c1ccccc1C2=O
InChIInChI=1S/C13H9NO/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)15/h1-7H,14H2
InChIKeyFFWCEONGEXZNFU-UHFFFAOYSA-N
MW195.22 g/mol
LogP2.48
Rot. Bonds

About 4-aminofluoren-9-one

4-aminofluoren-9-one (PubChem CID 20267) has the molecular formula C13H9NO and a molecular weight of 195.22 g/mol. Its IUPAC name is 4-aminofluoren-9-one.

Molecular Properties

Compound Name4-aminofluoren-9-one
PubChem CID20267
Molecular FormulaC13H9NO
Molecular Weight195.22 g/mol
Exact Mass195.07
IUPAC Name4-aminofluoren-9-one
SMILESNc1cccc2c1-c1ccccc1C2=O
InChIInChI=1S/C13H9NO/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)15/h1-7H,14H2
InChIKeyFFWCEONGEXZNFU-UHFFFAOYSA-N
XLogP2.48
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-aminofluoren-9-one?
The IUPAC name of 4-aminofluoren-9-one (CID 20267) is 4-aminofluoren-9-one.
What is the SMILES notation for 4-aminofluoren-9-one?
The canonical SMILES for 4-aminofluoren-9-one is Nc1cccc2c1-c1ccccc1C2=O.
What is the InChIKey of 4-aminofluoren-9-one?
The InChIKey is FFWCEONGEXZNFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9NO/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)15/h1-7H,14H2.
What are the key properties of 4-aminofluoren-9-one?
4-aminofluoren-9-one has a molecular weight of 195.22 g/mol, XLogP of 2.48, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-aminofluoren-9-one is sourced from PubChem (CID 20267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).