2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide

C9H11N3O4 — CID 67266270

IUPAC2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide
SMILESCOCC(=O)Nc1ccc([N+](=O)[O-])c(C)n1
InChIInChI=1S/C9H11N3O4/c1-6-7(12(14)15)3-4-8(10-6)11-9(13)5-16-2/h3-4H,5H2,1-2H3,(H,10,11,13)
InChIKeyNLCFZGFPTRDAJU-UHFFFAOYSA-N
MW225.20 g/mol
LogP0.88
Rot. Bonds4

About 2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide

2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide (PubChem CID 67266270) has the molecular formula C9H11N3O4 and a molecular weight of 225.20 g/mol. Its IUPAC name is 2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide
PubChem CID67266270
Molecular FormulaC9H11N3O4
Molecular Weight225.20 g/mol
Exact Mass225.07
IUPAC Name2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide
SMILESCOCC(=O)Nc1ccc([N+](=O)[O-])c(C)n1
InChIInChI=1S/C9H11N3O4/c1-6-7(12(14)15)3-4-8(10-6)11-9(13)5-16-2/h3-4H,5H2,1-2H3,(H,10,11,13)
InChIKeyNLCFZGFPTRDAJU-UHFFFAOYSA-N
XLogP0.88
TPSA94.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.20
LogP ≤ 50.88
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

1-methoxy-3-[(6-methyl-5-nitro-2-pyridinyl)amino]propan-2-ol
CID 80712438
N-(4-methoxybutan-2-yl)-6-methyl-5-nitropyridin-2-amine
CID 80712210
N-[(4-methoxyphenyl)methyl]-6-methyl-5-nitropyridin-2-amine
CID 80718457
N-(2-methoxypropyl)-6-methyl-5-nitropyridin-2-amine
CID 102698850
5-bromo-N-(6-methyl-5-nitro-2-pyridinyl)pyridine-2-carboxamide
CID 75513075
3-fluoro-N-(6-methyl-5-nitro-2-pyridinyl)pyridine-4-carboxamide
CID 71849348
2-(4-methoxyphenyl)-2-[(6-methyl-5-nitro-2-pyridinyl)amino]ethanol
CID 84588442
N-but-2-ynyl-6-methyl-5-nitropyridin-2-amine
CID 115903970
1,1-dimethyl-3-[2-[(6-methyl-5-nitro-2-pyridinyl)amino]ethyl]urea
CID 83113239
2-ethyl-2-[[(6-methyl-5-nitro-2-pyridinyl)amino]methyl]butanoic acid
CID 115430143
(2R)-3-methyl-2-[(6-methyl-5-nitro-2-pyridinyl)amino]butan-1-ol
CID 11447797
N-[(4-aminophenyl)methyl]-6-methyl-5-nitropyridin-2-amine
CID 116650504

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide?
The IUPAC name of 2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide (CID 67266270) is 2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide.
What is the SMILES notation for 2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide?
The canonical SMILES for 2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide is COCC(=O)Nc1ccc([N+](=O)[O-])c(C)n1.
What is the InChIKey of 2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide?
The InChIKey is NLCFZGFPTRDAJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O4/c1-6-7(12(14)15)3-4-8(10-6)11-9(13)5-16-2/h3-4H,5H2,1-2H3,(H,10,11,13).
What are the key properties of 2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide?
2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide has a molecular weight of 225.20 g/mol, XLogP of 0.88, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(6-methyl-5-nitro-2-pyridinyl)acetamide is sourced from PubChem (CID 67266270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).