1-(fluoromethyl)-2-oxopyridine-3-carboxamide

C7H7FN2O2 — CID 141218771

IUPAC1-(fluoromethyl)-2-oxopyridine-3-carboxamide
SMILESNC(=O)c1cccn(CF)c1=O
InChIInChI=1S/C7H7FN2O2/c8-4-10-3-1-2-5(6(9)11)7(10)12/h1-3H,4H2,(H2,9,11)
InChIKeyJRLLCWRGDVAQTC-UHFFFAOYSA-N
MW170.14 g/mol
LogP-0.13
Rot. Bonds2

About 1-(fluoromethyl)-2-oxopyridine-3-carboxamide

1-(fluoromethyl)-2-oxopyridine-3-carboxamide (PubChem CID 141218771) has the molecular formula C7H7FN2O2 and a molecular weight of 170.14 g/mol. Its IUPAC name is 1-(fluoromethyl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(fluoromethyl)-2-oxopyridine-3-carboxamide
PubChem CID141218771
Molecular FormulaC7H7FN2O2
Molecular Weight170.14 g/mol
Exact Mass170.05
IUPAC Name1-(fluoromethyl)-2-oxopyridine-3-carboxamide
SMILESNC(=O)c1cccn(CF)c1=O
InChIInChI=1S/C7H7FN2O2/c8-4-10-3-1-2-5(6(9)11)7(10)12/h1-3H,4H2,(H2,9,11)
InChIKeyJRLLCWRGDVAQTC-UHFFFAOYSA-N
XLogP-0.13
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.14
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(fluoromethyl)-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-(fluoromethyl)-2-oxopyridine-3-carboxamide (CID 141218771) is 1-(fluoromethyl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(fluoromethyl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(fluoromethyl)-2-oxopyridine-3-carboxamide is NC(=O)c1cccn(CF)c1=O.
What is the InChIKey of 1-(fluoromethyl)-2-oxopyridine-3-carboxamide?
The InChIKey is JRLLCWRGDVAQTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2O2/c8-4-10-3-1-2-5(6(9)11)7(10)12/h1-3H,4H2,(H2,9,11).
What are the key properties of 1-(fluoromethyl)-2-oxopyridine-3-carboxamide?
1-(fluoromethyl)-2-oxopyridine-3-carboxamide has a molecular weight of 170.14 g/mol, XLogP of -0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(fluoromethyl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 141218771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).