2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide

C10H10BrF3N2O3 — CID 103723268

IUPAC2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
SMILESO=C(Cn1cc(Br)ccc1=O)NCC(O)C(F)(F)F
InChIInChI=1S/C10H10BrF3N2O3/c11-6-1-2-9(19)16(4-6)5-8(18)15-3-7(17)10(12,13)14/h1-2,4,7,17H,3,5H2,(H,15,18)
InChIKeyNWPMABPMXIJUKS-UHFFFAOYSA-N
MW343.10 g/mol
LogP0.65
Rot. Bonds4

About 2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide

2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide (PubChem CID 103723268) has the molecular formula C10H10BrF3N2O3 and a molecular weight of 343.10 g/mol. Its IUPAC name is 2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
PubChem CID103723268
Molecular FormulaC10H10BrF3N2O3
Molecular Weight343.10 g/mol
Exact Mass341.98
IUPAC Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
SMILESO=C(Cn1cc(Br)ccc1=O)NCC(O)C(F)(F)F
InChIInChI=1S/C10H10BrF3N2O3/c11-6-1-2-9(19)16(4-6)5-8(18)15-3-7(17)10(12,13)14/h1-2,4,7,17H,3,5H2,(H,15,18)
InChIKeyNWPMABPMXIJUKS-UHFFFAOYSA-N
XLogP0.65
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.10
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide?
The IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide (CID 103723268) is 2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide?
The canonical SMILES for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide is O=C(Cn1cc(Br)ccc1=O)NCC(O)C(F)(F)F.
What is the InChIKey of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide?
The InChIKey is NWPMABPMXIJUKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrF3N2O3/c11-6-1-2-9(19)16(4-6)5-8(18)15-3-7(17)10(12,13)14/h1-2,4,7,17H,3,5H2,(H,15,18).
What are the key properties of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide?
2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide has a molecular weight of 343.10 g/mol, XLogP of 0.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide is sourced from PubChem (CID 103723268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).