8-fluoro-2-methyl-1H-quinolin-4-one

C10H8FNO — CID 15395998

IUPAC8-fluoro-2-methyl-1H-quinolin-4-one
SMILESCc1cc(=O)c2cccc(F)c2[nH]1
InChIInChI=1S/C10H8FNO/c1-6-5-9(13)7-3-2-4-8(11)10(7)12-6/h2-5H,1H3,(H,12,13)
InChIKeyLLUXFHIYAWGJGO-UHFFFAOYSA-N
MW177.18 g/mol
LogP1.98
Rot. Bonds

About 8-fluoro-2-methyl-1H-quinolin-4-one

8-fluoro-2-methyl-1H-quinolin-4-one (PubChem CID 15395998) has the molecular formula C10H8FNO and a molecular weight of 177.18 g/mol. Its IUPAC name is 8-fluoro-2-methyl-1H-quinolin-4-one.

Molecular Properties

Compound Name8-fluoro-2-methyl-1H-quinolin-4-one
PubChem CID15395998
Molecular FormulaC10H8FNO
Molecular Weight177.18 g/mol
Exact Mass177.06
IUPAC Name8-fluoro-2-methyl-1H-quinolin-4-one
SMILESCc1cc(=O)c2cccc(F)c2[nH]1
InChIInChI=1S/C10H8FNO/c1-6-5-9(13)7-3-2-4-8(11)10(7)12-6/h2-5H,1H3,(H,12,13)
InChIKeyLLUXFHIYAWGJGO-UHFFFAOYSA-N
XLogP1.98
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.18
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2-methyl-1H-quinolin-4-one?
The IUPAC name of 8-fluoro-2-methyl-1H-quinolin-4-one (CID 15395998) is 8-fluoro-2-methyl-1H-quinolin-4-one.
What is the SMILES notation for 8-fluoro-2-methyl-1H-quinolin-4-one?
The canonical SMILES for 8-fluoro-2-methyl-1H-quinolin-4-one is Cc1cc(=O)c2cccc(F)c2[nH]1.
What is the InChIKey of 8-fluoro-2-methyl-1H-quinolin-4-one?
The InChIKey is LLUXFHIYAWGJGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO/c1-6-5-9(13)7-3-2-4-8(11)10(7)12-6/h2-5H,1H3,(H,12,13).
What are the key properties of 8-fluoro-2-methyl-1H-quinolin-4-one?
8-fluoro-2-methyl-1H-quinolin-4-one has a molecular weight of 177.18 g/mol, XLogP of 1.98, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2-methyl-1H-quinolin-4-one is sourced from PubChem (CID 15395998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).