N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide

C15H15N3O4 — CID 7890330

IUPACN-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
SMILESCCc1ccccc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O
InChIInChI=1S/C15H15N3O4/c1-2-11-5-3-4-6-13(11)16-14(19)10-17-9-12(18(21)22)7-8-15(17)20/h3-9H,2,10H2,1H3,(H,16,19)
InChIKeyAKJRQGOYPBWVDO-UHFFFAOYSA-N
MW301.30 g/mol
LogP1.96
Rot. Bonds5

About N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide

N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide (PubChem CID 7890330) has the molecular formula C15H15N3O4 and a molecular weight of 301.30 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
PubChem CID7890330
Molecular FormulaC15H15N3O4
Molecular Weight301.30 g/mol
Exact Mass301.11
IUPAC NameN-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
SMILESCCc1ccccc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O
InChIInChI=1S/C15H15N3O4/c1-2-11-5-3-4-6-13(11)16-14(19)10-17-9-12(18(21)22)7-8-15(17)20/h3-9H,2,10H2,1H3,(H,16,19)
InChIKeyAKJRQGOYPBWVDO-UHFFFAOYSA-N
XLogP1.96
TPSA94.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.30
LogP ≤ 51.96
H-Bond Donors ≤ 51
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'}

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Related Compounds

N-(2,6-diethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 7890319
N-(2-cyanophenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 7467854
2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-ethylphenyl)acetamide
CID 26051552
N-cyclopropyl-2-[[2-(5-nitro-2-oxo-1-pyridinyl)acetyl]amino]benzamide
CID 16610937
N-(4-chloro-2-fluorophenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 7890392
N-[(2R)-butan-2-yl]-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 7467794
2-(5-nitro-2-oxo-1-pyridinyl)-N-[(1R)-1-phenylethyl]acetamide
CID 7890378
2-(5-amino-2-oxo-1-pyridinyl)-N-(2-propylphenyl)acetamide
CID 62816883
N-[3-(aminomethyl)pentan-3-yl]-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 119571533
N-(4-bromophenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 7890242
3-(5-nitro-2-oxo-1-pyridinyl)-N-(2-nitrophenyl)propanamide
CID 52569963
N-(2-ethylphenyl)-2-(2-oxo-5-piperidin-1-ylsulfonyl-1-pyridinyl)acetamide
CID 53170607

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide (CID 7890330) is N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide is CCc1ccccc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O.
What is the InChIKey of N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide?
The InChIKey is AKJRQGOYPBWVDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O4/c1-2-11-5-3-4-6-13(11)16-14(19)10-17-9-12(18(21)22)7-8-15(17)20/h3-9H,2,10H2,1H3,(H,16,19).
What are the key properties of N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide?
N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide has a molecular weight of 301.30 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 7890330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).