3-amino-1-(fluoromethyl)pyridin-2-one

C6H7FN2O — CID 169132497

IUPAC3-amino-1-(fluoromethyl)pyridin-2-one
SMILESNc1cccn(CF)c1=O
InChIInChI=1S/C6H7FN2O/c7-4-9-3-1-2-5(8)6(9)10/h1-3H,4,8H2
InChIKeyMWXWNPZMKBBPAB-UHFFFAOYSA-N
MW142.13 g/mol
LogP0.36
Rot. Bonds1

About 3-amino-1-(fluoromethyl)pyridin-2-one

3-amino-1-(fluoromethyl)pyridin-2-one (PubChem CID 169132497) has the molecular formula C6H7FN2O and a molecular weight of 142.13 g/mol. Its IUPAC name is 3-amino-1-(fluoromethyl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-(fluoromethyl)pyridin-2-one
PubChem CID169132497
Molecular FormulaC6H7FN2O
Molecular Weight142.13 g/mol
Exact Mass142.05
IUPAC Name3-amino-1-(fluoromethyl)pyridin-2-one
SMILESNc1cccn(CF)c1=O
InChIInChI=1S/C6H7FN2O/c7-4-9-3-1-2-5(8)6(9)10/h1-3H,4,8H2
InChIKeyMWXWNPZMKBBPAB-UHFFFAOYSA-N
XLogP0.36
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.13
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(fluoromethyl)pyridin-2-one?
The IUPAC name of 3-amino-1-(fluoromethyl)pyridin-2-one (CID 169132497) is 3-amino-1-(fluoromethyl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-(fluoromethyl)pyridin-2-one?
The canonical SMILES for 3-amino-1-(fluoromethyl)pyridin-2-one is Nc1cccn(CF)c1=O.
What is the InChIKey of 3-amino-1-(fluoromethyl)pyridin-2-one?
The InChIKey is MWXWNPZMKBBPAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2O/c7-4-9-3-1-2-5(8)6(9)10/h1-3H,4,8H2.
What are the key properties of 3-amino-1-(fluoromethyl)pyridin-2-one?
3-amino-1-(fluoromethyl)pyridin-2-one has a molecular weight of 142.13 g/mol, XLogP of 0.36, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(fluoromethyl)pyridin-2-one is sourced from PubChem (CID 169132497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).