7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one

C12H14FNO — CID 163270720

IUPAC7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one
SMILESCC(C)N1C(=O)CCc2ccc(F)cc21
InChIInChI=1S/C12H14FNO/c1-8(2)14-11-7-10(13)5-3-9(11)4-6-12(14)15/h3,5,7-8H,4,6H2,1-2H3
InChIKeyZFNKFINHLLIJCN-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.51
Rot. Bonds1

About 7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one

7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one (PubChem CID 163270720) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is 7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one
PubChem CID163270720
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC Name7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one
SMILESCC(C)N1C(=O)CCc2ccc(F)cc21
InChIInChI=1S/C12H14FNO/c1-8(2)14-11-7-10(13)5-3-9(11)4-6-12(14)15/h3,5,7-8H,4,6H2,1-2H3
InChIKeyZFNKFINHLLIJCN-UHFFFAOYSA-N
XLogP2.51
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one?
The IUPAC name of 7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one (CID 163270720) is 7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one is CC(C)N1C(=O)CCc2ccc(F)cc21.
What is the InChIKey of 7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one?
The InChIKey is ZFNKFINHLLIJCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c1-8(2)14-11-7-10(13)5-3-9(11)4-6-12(14)15/h3,5,7-8H,4,6H2,1-2H3.
What are the key properties of 7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one?
7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one has a molecular weight of 207.25 g/mol, XLogP of 2.51, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-1-propan-2-yl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 163270720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).