N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide

C16H14F3N3O3 — CID 7277669

IUPACN-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESCC(=O)Nc1cccc(NC(=O)Cn2cc(C(F)(F)F)ccc2=O)c1
InChIInChI=1S/C16H14F3N3O3/c1-10(23)20-12-3-2-4-13(7-12)21-14(24)9-22-8-11(16(17,18)19)5-6-15(22)25/h2-8H,9H2,1H3,(H,20,23)(H,21,24)
InChIKeyUMTSSTXEFLDAJE-UHFFFAOYSA-N
MW353.30 g/mol
LogP2.46
Rot. Bonds4

About N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide

N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide (PubChem CID 7277669) has the molecular formula C16H14F3N3O3 and a molecular weight of 353.30 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
PubChem CID7277669
Molecular FormulaC16H14F3N3O3
Molecular Weight353.30 g/mol
Exact Mass353.10
IUPAC NameN-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESCC(=O)Nc1cccc(NC(=O)Cn2cc(C(F)(F)F)ccc2=O)c1
InChIInChI=1S/C16H14F3N3O3/c1-10(23)20-12-3-2-4-13(7-12)21-14(24)9-22-8-11(16(17,18)19)5-6-15(22)25/h2-8H,9H2,1H3,(H,20,23)(H,21,24)
InChIKeyUMTSSTXEFLDAJE-UHFFFAOYSA-N
XLogP2.46
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.30
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide (CID 7277669) is N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide is CC(=O)Nc1cccc(NC(=O)Cn2cc(C(F)(F)F)ccc2=O)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The InChIKey is UMTSSTXEFLDAJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3N3O3/c1-10(23)20-12-3-2-4-13(7-12)21-14(24)9-22-8-11(16(17,18)19)5-6-15(22)25/h2-8H,9H2,1H3,(H,20,23)(H,21,24).
What are the key properties of N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide has a molecular weight of 353.30 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide is sourced from PubChem (CID 7277669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).