N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide

C14H11F2N3O5 — CID 47091849

IUPACN-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide
SMILESO=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C14H11F2N3O5/c15-14(16)24-11-6-2-1-4-9(11)17-12(20)8-18-7-3-5-10(13(18)21)19(22)23/h1-7,14H,8H2,(H,17,20)
InChIKeyHPCVDUPBOLWBCY-UHFFFAOYSA-N
MW339.25 g/mol
LogP2.00
Rot. Bonds6

About N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide

N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide (PubChem CID 47091849) has the molecular formula C14H11F2N3O5 and a molecular weight of 339.25 g/mol. Its IUPAC name is N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide
PubChem CID47091849
Molecular FormulaC14H11F2N3O5
Molecular Weight339.25 g/mol
Exact Mass339.07
IUPAC NameN-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide
SMILESO=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C14H11F2N3O5/c15-14(16)24-11-6-2-1-4-9(11)17-12(20)8-18-7-3-5-10(13(18)21)19(22)23/h1-7,14H,8H2,(H,17,20)
InChIKeyHPCVDUPBOLWBCY-UHFFFAOYSA-N
XLogP2.00
TPSA103.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.25
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide
CID 75505848
N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide
CID 39723759
[2-[2-(difluoromethoxy)anilino]-2-oxoethyl] 2-methyl-3-nitrobenzoate
CID 2119005
[2-[2-(difluoromethoxy)anilino]-2-oxoethyl] 4-amino-3-nitrobenzoate
CID 7781439
(E)-N-[2-(difluoromethoxy)phenyl]-3-(2-nitrophenyl)prop-2-enamide
CID 17395073
N-[2-(difluoromethoxy)phenyl]-2-(4-fluorophenyl)sulfanylacetamide
CID 2994410
N-[2-(difluoromethoxy)phenyl]-2-(2-fluorophenyl)sulfanylacetamide
CID 2591520
N-[2-(difluoromethoxy)phenyl]-2-(4-methylphenyl)sulfanylacetamide
CID 2995782
N-[2-(difluoromethoxy)phenyl]-4-methylsulfanyl-3-nitrobenzamide
CID 2671084
N-[2-(difluoromethoxy)phenyl]-2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 2622460
1-[3-(4-fluorophenyl)-2-oxopropyl]-3-nitropyridin-2-one
CID 62101144
2-[4-[2-(butan-2-ylamino)-2-oxoethyl]piperazin-1-yl]-N-[2-(difluoromethoxy)phenyl]acetamide
CID 55565889

Frequently Asked Questions

What is the IUPAC name of N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide (CID 47091849) is N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide is O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1ccccc1OC(F)F.
What is the InChIKey of N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide?
The InChIKey is HPCVDUPBOLWBCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2N3O5/c15-14(16)24-11-6-2-1-4-9(11)17-12(20)8-18-7-3-5-10(13(18)21)19(22)23/h1-7,14H,8H2,(H,17,20).
What are the key properties of N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide?
N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide has a molecular weight of 339.25 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(difluoromethoxy)phenyl]-2-(3-nitro-2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 47091849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).