6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one

C11H13FN2O — CID 84621050

IUPAC6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one
SMILESCNC1CC(=O)N(C)c2ccc(F)cc21
InChIInChI=1S/C11H13FN2O/c1-13-9-6-11(15)14(2)10-4-3-7(12)5-8(9)10/h3-5,9,13H,6H2,1-2H3
InChIKeySJIKYKNLDNJUDD-UHFFFAOYSA-N
MW208.24 g/mol
LogP1.45
Rot. Bonds1

About 6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one

6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one (PubChem CID 84621050) has the molecular formula C11H13FN2O and a molecular weight of 208.24 g/mol. Its IUPAC name is 6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one
PubChem CID84621050
Molecular FormulaC11H13FN2O
Molecular Weight208.24 g/mol
Exact Mass208.10
IUPAC Name6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one
SMILESCNC1CC(=O)N(C)c2ccc(F)cc21
InChIInChI=1S/C11H13FN2O/c1-13-9-6-11(15)14(2)10-4-3-7(12)5-8(9)10/h3-5,9,13H,6H2,1-2H3
InChIKeySJIKYKNLDNJUDD-UHFFFAOYSA-N
XLogP1.45
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one?
The IUPAC name of 6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one (CID 84621050) is 6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one is CNC1CC(=O)N(C)c2ccc(F)cc21.
What is the InChIKey of 6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one?
The InChIKey is SJIKYKNLDNJUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O/c1-13-9-6-11(15)14(2)10-4-3-7(12)5-8(9)10/h3-5,9,13H,6H2,1-2H3.
What are the key properties of 6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one?
6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one has a molecular weight of 208.24 g/mol, XLogP of 1.45, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-methyl-4-(methylamino)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 84621050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).