2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide

C10H12F3N3O2 — CID 55174936

IUPAC2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide
SMILESNc1ccc(=O)n(CC(=O)NCCC(F)(F)F)c1
InChIInChI=1S/C10H12F3N3O2/c11-10(12,13)3-4-15-8(17)6-16-5-7(14)1-2-9(16)18/h1-2,5H,3-4,6,14H2,(H,15,17)
InChIKeyVNZPKHCIFUKIOF-UHFFFAOYSA-N
MW263.22 g/mol
LogP0.50
Rot. Bonds4

About 2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide

2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide (PubChem CID 55174936) has the molecular formula C10H12F3N3O2 and a molecular weight of 263.22 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide
PubChem CID55174936
Molecular FormulaC10H12F3N3O2
Molecular Weight263.22 g/mol
Exact Mass263.09
IUPAC Name2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide
SMILESNc1ccc(=O)n(CC(=O)NCCC(F)(F)F)c1
InChIInChI=1S/C10H12F3N3O2/c11-10(12,13)3-4-15-8(17)6-16-5-7(14)1-2-9(16)18/h1-2,5H,3-4,6,14H2,(H,15,17)
InChIKeyVNZPKHCIFUKIOF-UHFFFAOYSA-N
XLogP0.50
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.22
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide?
The IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide (CID 55174936) is 2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide?
The canonical SMILES for 2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide is Nc1ccc(=O)n(CC(=O)NCCC(F)(F)F)c1.
What is the InChIKey of 2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide?
The InChIKey is VNZPKHCIFUKIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3O2/c11-10(12,13)3-4-15-8(17)6-16-5-7(14)1-2-9(16)18/h1-2,5H,3-4,6,14H2,(H,15,17).
What are the key properties of 2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide?
2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide has a molecular weight of 263.22 g/mol, XLogP of 0.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoropropyl)acetamide is sourced from PubChem (CID 55174936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).