6-(2-fluoroethylamino)-1-methylpyridin-2-one

C8H11FN2O — CID 130701766

IUPAC6-(2-fluoroethylamino)-1-methylpyridin-2-one
SMILESCn1c(NCCF)cccc1=O
InChIInChI=1S/C8H11FN2O/c1-11-7(10-6-5-9)3-2-4-8(11)12/h2-4,10H,5-6H2,1H3
InChIKeySPKQGADTVYQXFV-UHFFFAOYSA-N
MW170.19 g/mol
LogP0.77
Rot. Bonds3

About 6-(2-fluoroethylamino)-1-methylpyridin-2-one

6-(2-fluoroethylamino)-1-methylpyridin-2-one (PubChem CID 130701766) has the molecular formula C8H11FN2O and a molecular weight of 170.19 g/mol. Its IUPAC name is 6-(2-fluoroethylamino)-1-methylpyridin-2-one.

Molecular Properties

Compound Name6-(2-fluoroethylamino)-1-methylpyridin-2-one
PubChem CID130701766
Molecular FormulaC8H11FN2O
Molecular Weight170.19 g/mol
Exact Mass170.09
IUPAC Name6-(2-fluoroethylamino)-1-methylpyridin-2-one
SMILESCn1c(NCCF)cccc1=O
InChIInChI=1S/C8H11FN2O/c1-11-7(10-6-5-9)3-2-4-8(11)12/h2-4,10H,5-6H2,1H3
InChIKeySPKQGADTVYQXFV-UHFFFAOYSA-N
XLogP0.77
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.19
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoroethylamino)-1-methylpyridin-2-one?
The IUPAC name of 6-(2-fluoroethylamino)-1-methylpyridin-2-one (CID 130701766) is 6-(2-fluoroethylamino)-1-methylpyridin-2-one.
What is the SMILES notation for 6-(2-fluoroethylamino)-1-methylpyridin-2-one?
The canonical SMILES for 6-(2-fluoroethylamino)-1-methylpyridin-2-one is Cn1c(NCCF)cccc1=O.
What is the InChIKey of 6-(2-fluoroethylamino)-1-methylpyridin-2-one?
The InChIKey is SPKQGADTVYQXFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2O/c1-11-7(10-6-5-9)3-2-4-8(11)12/h2-4,10H,5-6H2,1H3.
What are the key properties of 6-(2-fluoroethylamino)-1-methylpyridin-2-one?
6-(2-fluoroethylamino)-1-methylpyridin-2-one has a molecular weight of 170.19 g/mol, XLogP of 0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoroethylamino)-1-methylpyridin-2-one is sourced from PubChem (CID 130701766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).