fluoren-1-one

C13H8O — CID 22281833

IUPACfluoren-1-one
SMILESO=C1C=CC=C2C1=Cc1ccccc12
InChIInChI=1S/C13H8O/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13/h1-8H
InChIKeyNWPWGNPPZVZAKO-UHFFFAOYSA-N
MW180.21 g/mol
LogP2.61
Rot. Bonds

About fluoren-1-one

fluoren-1-one (PubChem CID 22281833) has the molecular formula C13H8O and a molecular weight of 180.21 g/mol. Its IUPAC name is fluoren-1-one.

Molecular Properties

Compound Namefluoren-1-one
PubChem CID22281833
Molecular FormulaC13H8O
Molecular Weight180.21 g/mol
Exact Mass180.06
IUPAC Namefluoren-1-one
SMILESO=C1C=CC=C2C1=Cc1ccccc12
InChIInChI=1S/C13H8O/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13/h1-8H
InChIKeyNWPWGNPPZVZAKO-UHFFFAOYSA-N
XLogP2.61
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of fluoren-1-one?
The IUPAC name of fluoren-1-one (CID 22281833) is fluoren-1-one.
What is the SMILES notation for fluoren-1-one?
The canonical SMILES for fluoren-1-one is O=C1C=CC=C2C1=Cc1ccccc12.
What is the InChIKey of fluoren-1-one?
The InChIKey is NWPWGNPPZVZAKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8O/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13/h1-8H.
What are the key properties of fluoren-1-one?
fluoren-1-one has a molecular weight of 180.21 g/mol, XLogP of 2.61, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoren-1-one is sourced from PubChem (CID 22281833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).