3-(ethylamino)-5-fluoro-1H-pyridin-2-one

C7H9FN2O — CID 142523723

IUPAC3-(ethylamino)-5-fluoro-1H-pyridin-2-one
SMILESCCNc1cc(F)c[nH]c1=O
InChIInChI=1S/C7H9FN2O/c1-2-9-6-3-5(8)4-10-7(6)11/h3-4,9H,2H2,1H3,(H,10,11)
InChIKeyNWTCHVCOJBFJFX-UHFFFAOYSA-N
MW156.16 g/mol
LogP0.95
Rot. Bonds2

About 3-(ethylamino)-5-fluoro-1H-pyridin-2-one

3-(ethylamino)-5-fluoro-1H-pyridin-2-one (PubChem CID 142523723) has the molecular formula C7H9FN2O and a molecular weight of 156.16 g/mol. Its IUPAC name is 3-(ethylamino)-5-fluoro-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(ethylamino)-5-fluoro-1H-pyridin-2-one
PubChem CID142523723
Molecular FormulaC7H9FN2O
Molecular Weight156.16 g/mol
Exact Mass156.07
IUPAC Name3-(ethylamino)-5-fluoro-1H-pyridin-2-one
SMILESCCNc1cc(F)c[nH]c1=O
InChIInChI=1S/C7H9FN2O/c1-2-9-6-3-5(8)4-10-7(6)11/h3-4,9H,2H2,1H3,(H,10,11)
InChIKeyNWTCHVCOJBFJFX-UHFFFAOYSA-N
XLogP0.95
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.16
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-5-fluoro-1H-pyridin-2-one?
The IUPAC name of 3-(ethylamino)-5-fluoro-1H-pyridin-2-one (CID 142523723) is 3-(ethylamino)-5-fluoro-1H-pyridin-2-one.
What is the SMILES notation for 3-(ethylamino)-5-fluoro-1H-pyridin-2-one?
The canonical SMILES for 3-(ethylamino)-5-fluoro-1H-pyridin-2-one is CCNc1cc(F)c[nH]c1=O.
What is the InChIKey of 3-(ethylamino)-5-fluoro-1H-pyridin-2-one?
The InChIKey is NWTCHVCOJBFJFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN2O/c1-2-9-6-3-5(8)4-10-7(6)11/h3-4,9H,2H2,1H3,(H,10,11).
What are the key properties of 3-(ethylamino)-5-fluoro-1H-pyridin-2-one?
3-(ethylamino)-5-fluoro-1H-pyridin-2-one has a molecular weight of 156.16 g/mol, XLogP of 0.95, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-5-fluoro-1H-pyridin-2-one is sourced from PubChem (CID 142523723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).