3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one

C8H11FN2O2 — CID 118155161

IUPAC3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one
SMILESCOCCn1cc(F)cc(N)c1=O
InChIInChI=1S/C8H11FN2O2/c1-13-3-2-11-5-6(9)4-7(10)8(11)12/h4-5H,2-3,10H2,1H3
InChIKeyVSRNWERYAPRKPQ-UHFFFAOYSA-N
MW186.19 g/mol
LogP0.22
Rot. Bonds3

About 3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one

3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one (PubChem CID 118155161) has the molecular formula C8H11FN2O2 and a molecular weight of 186.19 g/mol. Its IUPAC name is 3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one
PubChem CID118155161
Molecular FormulaC8H11FN2O2
Molecular Weight186.19 g/mol
Exact Mass186.08
IUPAC Name3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one
SMILESCOCCn1cc(F)cc(N)c1=O
InChIInChI=1S/C8H11FN2O2/c1-13-3-2-11-5-6(9)4-7(10)8(11)12/h4-5H,2-3,10H2,1H3
InChIKeyVSRNWERYAPRKPQ-UHFFFAOYSA-N
XLogP0.22
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.19
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one?
The IUPAC name of 3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one (CID 118155161) is 3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one.
What is the SMILES notation for 3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one?
The canonical SMILES for 3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one is COCCn1cc(F)cc(N)c1=O.
What is the InChIKey of 3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one?
The InChIKey is VSRNWERYAPRKPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2O2/c1-13-3-2-11-5-6(9)4-7(10)8(11)12/h4-5H,2-3,10H2,1H3.
What are the key properties of 3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one?
3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one has a molecular weight of 186.19 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-fluoro-1-(2-methoxyethyl)pyridin-2-one is sourced from PubChem (CID 118155161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).