5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one

C17H17FN2O2 — CID 99831437

About 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one

5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one (PubChem CID 99831437) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one.

Molecular Properties

• Compound Name: 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one
• PubChem CID: 99831437
• Molecular Formula: C17H17FN2O2
• Molecular Weight: 300.33 g/mol
• Exact Mass: 300.13
• IUPAC Name: 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one
• SMILES: C[C@@H]1CCc2ccccc2N1C(=O)Cn1cc(F)ccc1=O
• InChI: InChI=1S/C17H17FN2O2/c1-12-6-7-13-4-2-3-5-15(13)20(12)17(22)11-19-10-14(18)8-9-16(19)21/h2-5,8-10,12H,6-7,11H2,1H3/t12-/m1/s1
• InChIKey: DVTFCRYQBLTNEU-GFCCVEGCSA-N
• XLogP: 2.36
• TPSA: 42.31 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 2
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	300.33
LogP ≤ 5	2.36
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one?

The IUPAC name of 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one (CID 99831437) is 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one.

What is the SMILES notation for 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one?

The canonical SMILES for 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one is C[C@@H]1CCc2ccccc2N1C(=O)Cn1cc(F)ccc1=O.

What is the InChIKey of 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one?

The InChIKey is DVTFCRYQBLTNEU-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H17FN2O2/c1-12-6-7-13-4-2-3-5-15(13)20(12)17(22)11-19-10-14(18)8-9-16(19)21/h2-5,8-10,12H,6-7,11H2,1H3/t12-/m1/s1.

What are the key properties of 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one?

5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one has a molecular weight of 300.33 g/mol, XLogP of 2.36, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one is sourced from PubChem (CID 99831437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).