8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one

C10H10FNO — CID 105437917

IUPAC8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one
SMILESCC1CC(=O)Nc2c(F)cccc21
InChIInChI=1S/C10H10FNO/c1-6-5-9(13)12-10-7(6)3-2-4-8(10)11/h2-4,6H,5H2,1H3,(H,12,13)
InChIKeyAAWUKELVEVILDH-UHFFFAOYSA-N
MW179.19 g/mol
LogP2.27
Rot. Bonds

About 8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one

8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one (PubChem CID 105437917) has the molecular formula C10H10FNO and a molecular weight of 179.19 g/mol. Its IUPAC name is 8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one
PubChem CID105437917
Molecular FormulaC10H10FNO
Molecular Weight179.19 g/mol
Exact Mass179.07
IUPAC Name8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one
SMILESCC1CC(=O)Nc2c(F)cccc21
InChIInChI=1S/C10H10FNO/c1-6-5-9(13)12-10-7(6)3-2-4-8(10)11/h2-4,6H,5H2,1H3,(H,12,13)
InChIKeyAAWUKELVEVILDH-UHFFFAOYSA-N
XLogP2.27
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.19
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one (CID 105437917) is 8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one is CC1CC(=O)Nc2c(F)cccc21.
What is the InChIKey of 8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is AAWUKELVEVILDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO/c1-6-5-9(13)12-10-7(6)3-2-4-8(10)11/h2-4,6H,5H2,1H3,(H,12,13).
What are the key properties of 8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one?
8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 179.19 g/mol, XLogP of 2.27, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-4-methyl-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 105437917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).