2-fluoro-10H-acridin-9-one

C13H8FNO — CID 2975401

IUPAC2-fluoro-10H-acridin-9-one
SMILESO=c1c2ccccc2[nH]c2ccc(F)cc12
InChIInChI=1S/C13H8FNO/c14-8-5-6-12-10(7-8)13(16)9-3-1-2-4-11(9)15-12/h1-7H,(H,15,16)
InChIKeyDNGYUVWGPVXTCR-UHFFFAOYSA-N
MW213.21 g/mol
LogP2.82
Rot. Bonds

About 2-fluoro-10H-acridin-9-one

2-fluoro-10H-acridin-9-one (PubChem CID 2975401) has the molecular formula C13H8FNO and a molecular weight of 213.21 g/mol. Its IUPAC name is 2-fluoro-10H-acridin-9-one.

Molecular Properties

Compound Name2-fluoro-10H-acridin-9-one
PubChem CID2975401
Molecular FormulaC13H8FNO
Molecular Weight213.21 g/mol
Exact Mass213.06
IUPAC Name2-fluoro-10H-acridin-9-one
SMILESO=c1c2ccccc2[nH]c2ccc(F)cc12
InChIInChI=1S/C13H8FNO/c14-8-5-6-12-10(7-8)13(16)9-3-1-2-4-11(9)15-12/h1-7H,(H,15,16)
InChIKeyDNGYUVWGPVXTCR-UHFFFAOYSA-N
XLogP2.82
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.21
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-10H-acridin-9-one?
The IUPAC name of 2-fluoro-10H-acridin-9-one (CID 2975401) is 2-fluoro-10H-acridin-9-one.
What is the SMILES notation for 2-fluoro-10H-acridin-9-one?
The canonical SMILES for 2-fluoro-10H-acridin-9-one is O=c1c2ccccc2[nH]c2ccc(F)cc12.
What is the InChIKey of 2-fluoro-10H-acridin-9-one?
The InChIKey is DNGYUVWGPVXTCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8FNO/c14-8-5-6-12-10(7-8)13(16)9-3-1-2-4-11(9)15-12/h1-7H,(H,15,16).
What are the key properties of 2-fluoro-10H-acridin-9-one?
2-fluoro-10H-acridin-9-one has a molecular weight of 213.21 g/mol, XLogP of 2.82, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-10H-acridin-9-one is sourced from PubChem (CID 2975401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).