N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide

C15H15N3O4 — CID 9453926

IUPACN-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide
SMILESCCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccccc1
InChIInChI=1S/C15H15N3O4/c1-2-17(12-6-4-3-5-7-12)15(20)11-16-10-13(18(21)22)8-9-14(16)19/h3-10H,2,11H2,1H3
InChIKeyVMRWZAUSNXOXQX-UHFFFAOYSA-N
MW301.30 g/mol
LogP1.81
Rot. Bonds5

About N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide

N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide (PubChem CID 9453926) has the molecular formula C15H15N3O4 and a molecular weight of 301.30 g/mol. Its IUPAC name is N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide.

Molecular Properties

Compound NameN-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide
PubChem CID9453926
Molecular FormulaC15H15N3O4
Molecular Weight301.30 g/mol
Exact Mass301.11
IUPAC NameN-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide
SMILESCCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccccc1
InChIInChI=1S/C15H15N3O4/c1-2-17(12-6-4-3-5-7-12)15(20)11-16-10-13(18(21)22)8-9-14(16)19/h3-10H,2,11H2,1H3
InChIKeyVMRWZAUSNXOXQX-UHFFFAOYSA-N
XLogP1.81
TPSA85.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.30
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-amino-2-oxo-1-pyridinyl)-N-ethyl-N-phenylacetamide
CID 62816852
N-(cyclohexen-1-yl)-N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 18127614
N-ethyl-N-(2-methylprop-2-enyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 84603998
3-[methyl-[2-(5-nitro-2-oxo-1-pyridinyl)acetyl]amino]propanoic acid
CID 119232404
N-(1-aminopropan-2-yl)-N-methyl-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 119584638
2-[[2-(5-nitro-2-oxo-1-pyridinyl)acetyl]-propan-2-ylamino]acetic acid
CID 119198013
2-(5-nitro-2-oxo-1-pyridinyl)-N-[(1R)-1-phenylethyl]acetamide
CID 7890378
N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 7890330
N-butyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-phenylacetamide
CID 43008462
N-[(2R)-butan-2-yl]-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 7467794
N-(2,6-diethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 7890319
ethyl (4S)-6-[(5-nitro-2-oxo-1-pyridinyl)methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 7571448

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide?
The IUPAC name of N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide (CID 9453926) is N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide.
What is the SMILES notation for N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide?
The canonical SMILES for N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide is CCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccccc1.
What is the InChIKey of N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide?
The InChIKey is VMRWZAUSNXOXQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O4/c1-2-17(12-6-4-3-5-7-12)15(20)11-16-10-13(18(21)22)8-9-14(16)19/h3-10H,2,11H2,1H3.
What are the key properties of N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide?
N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide has a molecular weight of 301.30 g/mol, XLogP of 1.81, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-nitro-2-oxo-1-pyridinyl)-N-phenylacetamide is sourced from PubChem (CID 9453926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).