8-fluoro-2-methyl-2H-quinolin-3-one

C10H8FNO — CID 172697902

IUPAC8-fluoro-2-methyl-2H-quinolin-3-one
SMILESCC1N=c2c(F)cccc2=CC1=O
InChIInChI=1S/C10H8FNO/c1-6-9(13)5-7-3-2-4-8(11)10(7)12-6/h2-6H,1H3
InChIKeyCOKVDUMBSPUICB-UHFFFAOYSA-N
MW177.18 g/mol
LogP0.20
Rot. Bonds

About 8-fluoro-2-methyl-2H-quinolin-3-one

8-fluoro-2-methyl-2H-quinolin-3-one (PubChem CID 172697902) has the molecular formula C10H8FNO and a molecular weight of 177.18 g/mol. Its IUPAC name is 8-fluoro-2-methyl-2H-quinolin-3-one.

Molecular Properties

Compound Name8-fluoro-2-methyl-2H-quinolin-3-one
PubChem CID172697902
Molecular FormulaC10H8FNO
Molecular Weight177.18 g/mol
Exact Mass177.06
IUPAC Name8-fluoro-2-methyl-2H-quinolin-3-one
SMILESCC1N=c2c(F)cccc2=CC1=O
InChIInChI=1S/C10H8FNO/c1-6-9(13)5-7-3-2-4-8(11)10(7)12-6/h2-6H,1H3
InChIKeyCOKVDUMBSPUICB-UHFFFAOYSA-N
XLogP0.20
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.18
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2-methyl-2H-quinolin-3-one?
The IUPAC name of 8-fluoro-2-methyl-2H-quinolin-3-one (CID 172697902) is 8-fluoro-2-methyl-2H-quinolin-3-one.
What is the SMILES notation for 8-fluoro-2-methyl-2H-quinolin-3-one?
The canonical SMILES for 8-fluoro-2-methyl-2H-quinolin-3-one is CC1N=c2c(F)cccc2=CC1=O.
What is the InChIKey of 8-fluoro-2-methyl-2H-quinolin-3-one?
The InChIKey is COKVDUMBSPUICB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO/c1-6-9(13)5-7-3-2-4-8(11)10(7)12-6/h2-6H,1H3.
What are the key properties of 8-fluoro-2-methyl-2H-quinolin-3-one?
8-fluoro-2-methyl-2H-quinolin-3-one has a molecular weight of 177.18 g/mol, XLogP of 0.20, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2-methyl-2H-quinolin-3-one is sourced from PubChem (CID 172697902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).