N-methoxy-N-methyl-5-nitropyridine-2-carboxamide

C8H9N3O4 — CID 169122058

IUPACN-methoxy-N-methyl-5-nitropyridine-2-carboxamide
SMILESCON(C)C(=O)c1ccc([N+](=O)[O-])cn1
InChIInChI=1S/C8H9N3O4/c1-10(15-2)8(12)7-4-3-6(5-9-7)11(13)14/h3-5H,1-2H3
InChIKeyGFLZHOXJAIPOEA-UHFFFAOYSA-N
MW211.18 g/mol
LogP0.62
Rot. Bonds3

About N-methoxy-N-methyl-5-nitropyridine-2-carboxamide

N-methoxy-N-methyl-5-nitropyridine-2-carboxamide (PubChem CID 169122058) has the molecular formula C8H9N3O4 and a molecular weight of 211.18 g/mol. Its IUPAC name is N-methoxy-N-methyl-5-nitropyridine-2-carboxamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-5-nitropyridine-2-carboxamide
PubChem CID169122058
Molecular FormulaC8H9N3O4
Molecular Weight211.18 g/mol
Exact Mass211.06
IUPAC NameN-methoxy-N-methyl-5-nitropyridine-2-carboxamide
SMILESCON(C)C(=O)c1ccc([N+](=O)[O-])cn1
InChIInChI=1S/C8H9N3O4/c1-10(15-2)8(12)7-4-3-6(5-9-7)11(13)14/h3-5H,1-2H3
InChIKeyGFLZHOXJAIPOEA-UHFFFAOYSA-N
XLogP0.62
TPSA85.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.18
LogP ≤ 50.62
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'}

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Related Compounds

5-chloro-N-methoxy-N-methylpyridine-2-carboxamide
CID 59108636
5-ethyl-N-methoxy-N-methylpyridine-2-carboxamide
CID 23143535
5-nitro-N-propylpyridine-2-carboxamide
CID 21405282
N-methoxy-N-methyl-5-(2-phenylethyl)pyridine-2-carboxamide
CID 175979322
5-nitropyridine-2-carbothioamide
CID 82668935
4-amino-N-methoxy-N-methylbenzamide;carbanide;methane;N-methoxy-N-methyl-4-nitrobenzamide;palladium
CID 162020244
N-hydrazinylidene-5-nitropyridine-2-carboxamide
CID 126667337
N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide
CID 158794501
N-butanoyl-5-nitropyridine-2-carboxamide
CID 21405268
CID 59369486
CID 59369486
(2E,4E)-N-methoxy-N-methyl-5-(4-nitrophenyl)penta-2,4-dienamide
CID 134907476
1-[5-(4-nitrophenyl)-2-pyridinyl]ethanone
CID 86680623

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-5-nitropyridine-2-carboxamide?
The IUPAC name of N-methoxy-N-methyl-5-nitropyridine-2-carboxamide (CID 169122058) is N-methoxy-N-methyl-5-nitropyridine-2-carboxamide.
What is the SMILES notation for N-methoxy-N-methyl-5-nitropyridine-2-carboxamide?
The canonical SMILES for N-methoxy-N-methyl-5-nitropyridine-2-carboxamide is CON(C)C(=O)c1ccc([N+](=O)[O-])cn1.
What is the InChIKey of N-methoxy-N-methyl-5-nitropyridine-2-carboxamide?
The InChIKey is GFLZHOXJAIPOEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O4/c1-10(15-2)8(12)7-4-3-6(5-9-7)11(13)14/h3-5H,1-2H3.
What are the key properties of N-methoxy-N-methyl-5-nitropyridine-2-carboxamide?
N-methoxy-N-methyl-5-nitropyridine-2-carboxamide has a molecular weight of 211.18 g/mol, XLogP of 0.62, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-5-nitropyridine-2-carboxamide is sourced from PubChem (CID 169122058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).